MORITA Akihiro 森田明弘

Researcher Number	70252418
Other IDs
Affiliation (Current)	2025: 東北大学, 理学研究科, 教授
Affiliation (based on the past Project Information) *help	2016 – 2025: 東北大学, 理学研究科, 教授 2012 – 2016: 東北大学, 理学(系)研究科(研究院), 教授 2014: 東北大学, 大学院理学研究科, 教授 2010 – 2011: 東北大学, 理学研究科, 教授 2007 – 2011: Tohoku University, 大学院・理学研究科, 教授 … More 2008: 東北大学, 大学院理学研究科, 教授 2005: NATIONAL INSTITUTE OF NATURAL SCIENCES, Research Center for Computational Science, Associate Professor, 計算科学研究センター, 助教授 2005: 大学共同利用機関法人自然科学研究機構(岡崎共通研究施設), 計算科学研究センター, 助教授 2004: 大学共同利用機関法人, 自然科学研究機構(岡崎共通研究施設)・計算科学研究センター, 助教授 2003: 岡崎国立共同研究機構, 計算科学研究センター, 助教授 2001 – 2002: 京都大学, 理学研究科, 助手 1998 – 2002: 京都大学, 大学院・理学研究科, 助手 1999: 京大, 理学(系)研究科, 助手 Less
Review Section/Research Field	Principal Investigator Physical chemistry / Science and Engineering / Physical chemistry / Basic Section 32010:Fundamental physical chemistry-related / Medium-sized Section 32:Physical chemistry, functional solid state chemistry, and related fields / Science and Engineering Except Principal Investigator Physical chemistry / Science and Engineering / Broad Section E / Science and Engineering
Keywords	Principal Investigator 分子動力学シミュレーション / 表面・界面 / 和周波発生 / 分子シミュレーション / 分子動力学 / 電解質水溶液 / 物質移動 / 振動分光 / 界面 / 和周波発生分光 … More / 拡散 / 気液界面 / 流体解析 / エアロゾル / 不均質大気化学 / 液体界面 / Condensation coefficient / Droplet train / Diffusion / Molecular dynamics / Mass accommodation coefficient / Uptake coefficient / Heterogeneous Atmospheric Chemistry / Liquid-Vapor Interface / HO2ラジカル / 凝結係数 / 液滴法 / 適応係数 / 取り込み係数 / イオン移動 / 分子シミュエーション / 相間移動触媒 / 液液界面 / イオン輸送 / 差スペクトル / 界面分光 / メチル基 / フェルミ共鳴 / Charge Response Kernel / 界面誘電率 / 電気二重層 / 硫酸エアロゾル / 表面 / 分子モデリング / chare resonse kernel / charge response kernel / 電子分極 / 分子軌道法 / オゾンホール / sum frequency generation / droplet train / mass accommodation coefficient … More Except Principal Investigator 界面 / 非線形分光 / 分子科学 / 表面・界面物性 / 電気二重層 / イオン液体 / 分子複雑系 / 超高速分光 / 分子動力学計算 / 機能創成 / 先端計測 / 理論・計算 / 分光エリプソメトリー / IV-SFG / Water / Vibrationa Spectra / Charge Polarization / Hamiltonian / Reaction Path / Dynamics / Chemical Reaction / Potential Surface / 溶媒効果 / 液体統計力学 / 分子動力学 / 電子状態 / 励起状態 / 溶液ダイナミックス / ダイナミックス / 電荷移動反応 / 積分方程式理論 / ポテンシャル面 / 溶液 / 化学反応 / 時空間分解計測 / 単一分子計測 / 時空間分光計測 / 生体関連分子 / 複雑分子系 / 相関分光 / ダイナミクス / 凝縮相 / 有機EL / カーボンナノチューブ / レーザー分光 / 表面・界面 / 和周波発生 / 表面 / 遷移金属錯体 / 相対論的量子化学 / 凝縮系 / 巨大分子系 / 生命量子論 / 理論精密分光学 / シュレーディンガー方程式の厳密解 / 化学原理 / 水和効果 / 反応中間体 / 分子軌道法 / ラジカル-水錯体 / ポテンシャルエネルギー面 / 気相ラジカル反応機構 / 分子動力学シミュレーション / 酸化反応機構 / 量子化学計算 / O2-H2O錯体 / 水和錯体 / ラジカル反応機構 / 大気ラジカル種 / HO2ラジカル / 分子シミュレーション / 取り込み係数 / エアロゾル / 地球温暖化 / 平衡定数 / 大気分子錯体 / 大気化学 Less

一般化自由エネルギー計算とマルチスケールMDに基づく液液界面の分子理論の発展Principal Investigator
- Principal Investigator
  
  森田明弘
- Project Period (FY)
  2025 – 2029
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Review Section
  
  Basic Section 32010:Fundamental physical chemistry-related
- Research Institution
  Tohoku University
Development of theory on sum frequency generation spectroscopyPrincipal Investigator
- Principal Investigator
  
  森田明弘
- Project Period (FY)
  2020 – 2024
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Review Section
  
  Medium-sized Section 32:Physical chemistry, functional solid state chemistry, and related fields
- Research Institution
  Tohoku University
Exploring Interface Science by Concerted Use of Advanced Spectroscopy and Theory
- Principal Investigator
  
  Tahara Tahei
- Project Period (FY)
  2018 – 2022
- Research Category
  
  Grant-in-Aid for Scientific Research (S)
- Review Section
  
  Broad Section E
- Research Institution
  Institute of Physical and Chemical Research
Support for International Activities of Studying the Function of Soft Molecular Systems by Concerted Use of Theory and Experiment
- Principal Investigator
  
  TAHARA Tahei
- Project Period (FY)
  2015 – 2017
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Science and Engineering
- Research Institution
  Institute of Physical and Chemical Research
Microscopic theory of phase transfer catalysis at liquid-liquid interfacesPrincipal Investigator
- Principal Investigator
  
  Morita Akihiro
- Project Period (FY)
  2014 – 2018
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Physical chemistry
- Research Institution
  Tohoku University
Structure and dynamics of ionic liquid/molecular liquid interfaces : functionality of interfaces under the application of potentials
- Principal Investigator
  
  Ouchi Yukio
- Project Period (FY)
  2014 – 2017
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Research Field
  
  Physical chemistry
- Research Institution
  Tokyo Institute of Technology
Theory of Structure and Functions of Liquid and Polymer InterfacesPrincipal Investigator
- Principal Investigator
  
  Morita Akihiro
- Project Period (FY)
  2013 – 2017
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Science and Engineering
- Research Institution
  Tohoku University
Study on the mechanism and functionality of the electric double layer of ionic liquid interfaces
- Principal Investigator
  
  OUCHI Yukio
- Project Period (FY)
  2011 – 2014
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Physical chemistry
- Research Institution
  Tokyo Institute of Technology
  Nagoya University
Theory and computational method of interfacial sum frequency generation spectrosocpyPrincipal Investigator
- Principal Investigator
  
  MORITA Akihiro
- Project Period (FY)
  2009 – 2013
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Research Field
  
  Physical chemistry
- Research Institution
  Tohoku University
実験と理論計算の連携による溶液界面構造の微視的解明Principal Investigator
- Principal Investigator
  
  森田明弘
- Project Period (FY)
  2008 – 2009
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  Tohoku University
分子シミュレーションに基づく和周波発生の理論の深化Principal Investigator
- Principal Investigator
  
  森田明弘
- Project Period (FY)
  2008 – 2009
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  Tohoku University
実験と理論計算の連携による界面和周波分光の解析Principal Investigator
- Principal Investigator
  
  森田明弘
- Project Period (FY)
  2007
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  Tohoku University
Study of complex molecular systems by advanced molecular spectroscopy
- Principal Investigator
  
  TAHARA Tahei
- Project Period (FY)
  2007 – 2011
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  The Institute of Physical and Chemical Research
Development of the two-color sum-frequency gener at ion spectrometer with wide range wavelength tunability
- Principal Investigator
  
  MIYAMAE Takayuki
- Project Period (FY)
  2006 – 2008
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Physical chemistry
- Research Institution
  National Institute of Advanced Industrial Science and Technology
Theoretical Study on Surface Structure and Mass Transfer at Atmospheric AerosolsPrincipal Investigator
- Principal Investigator
  
  MORITA Akihiro
- Project Period (FY)
  2003 – 2005
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Physical chemistry
- Research Institution
  National Institute of Natural Sciences Okazaki Research Facilities
  Okazaki National Research Institutes
量子的化学原理の深化と実現
- Principal Investigator
  
  中辻博
- Project Period (FY)
  2002 – 2006
- Research Category
  
  Grant-in-Aid for Creative Scientific Research
- Research Institution
  Kyoto University
ラジカル連鎖に関連する素反応過程の理論的研究
- Principal Investigator
  
  橋本健朗, 長村吉洋
- Project Period (FY)
  2001 – 2003
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  Tokyo Metropolitan University
  Rikkyo University
成層圏エアロゾル表面での不均質大気化学の理論的研究Principal Investigator
- Principal Investigator
  
  森田明弘
- Project Period (FY)
  2001 – 2002
- Research Category
  
  Grant-in-Aid for Young Scientists (B)
- Research Field
  
  Physical chemistry
- Research Institution
  Kyoto University
溶液内分子のダイナミックスと電子分極の理論的研究Principal Investigator
- Principal Investigator
  
  森田明弘
- Project Period (FY)
  1999
- Research Category
  
  Grant-in-Aid for Encouragement of Young Scientists (A)
- Research Field
  
  Physical chemistry
- Research Institution
  Kyoto University
Potentiai Energy Surfaces and Dynamics of Chemical Reactions in Solution
- Principal Investigator
  
  KATO Shigeki
- Project Period (FY)
  1998 – 2000
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas (B)
- Research Institution
  Kyoto University

[Book] Theory of Sum Frequency Generation Spectroscopy2018
- Author(s)
  Akihiro Morita
- Total Pages
  264
- Publisher
  Springer
- ISBN
  9789811316074
- Data Source
  KAKENHI-PROJECT-26288003
[Book] Theory of Sum Frequency Generation Spectroscopy2018
- Author(s)
  Akihiro Morita
- Total Pages
  264
- Publisher
  Springer
- ISBN
  9789811316074
- Data Source
  KAKENHI-PROJECT-18H05265
[Book] 「巨大分子系の計算化学」CSJ カレントレビュー・シリーズ第8巻第14章, "液体界面の分子の状態"2012
- Author(s)
  森田明弘, 他
- Publisher
  化学同人
- Data Source
  KAKENHI-PROJECT-21245002
[Book] 巨大分子系への計算化学CSJカレントレビュー・シリーズ第8巻"液体界面の分子の状態"2012
- Author(s)
  森田明弘
- Total Pages
  201
- Publisher
  化学同人
- Data Source
  KAKENHI-PROJECT-21245002
[Book] 大学院講義物理化学(第2版)第II巻第6章"溶液反応の速度論"2011
- Author(s)
  森田明弘
- Publisher
  東京化学同人
- Data Source
  KAKENHI-PROJECT-21245002
[Book] 大学院講義物理化学(第2版)第II巻第6章,"溶液反応の速度論"2011
- Author(s)
  森田明弘, 他
- Publisher
  東京化学同人
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Comment on “Sum-frequency vibrational spectroscopy of centrosymmetric molecule at interfaces” [J. Chem. Phys. 158, 074701 (2023)]2024
- Author(s)
  Hirano Tomonori、Kumagai Koichi、Ishiyama Tatsuya、Morita Akihiro
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 160 Issue: 10 Pages: 107101-107101
- DOI
  10.1063/5.0167357
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20H00368, KAKENHI-PROJECT-23K21095
[Journal Article] Identification of Ion Pairs in Aqueous NaCl and KCl Solutions in Combination with Raman Spectroscopy, Molecular Dynamics, and Quantum Chemical Calculations2023
- Author(s)
  Wang Lin、Morita Akihiro、North Nicole M.、Baumler Stephen M.、Springfield Elliot W.、Allen Heather C.
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 127 Issue: 7 Pages: 1618-1627
- DOI
  10.1021/acs.jpcb.2c07923
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Unraveling the Unstable Nature of Tetraglyme-Based Electrolytes toward Superoxide and the Inhibitory Effect of Lithium Ions by Using In Situ Vibrational Spectroscopies2022
- Author(s)
  A. Ge、R. Nagai、C. Xu、K. Kannari、B. Peng、K. Inoue、A. Morita、S. Ye
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 126 Issue: 6 Pages: 2980-2989
- DOI
  10.1021/acs.jpcc.1c10753
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Why the Photochemical Reaction of Phenol Becomes Ultrafast at the Air/Water Interface: The Effect of Surface Hydration2022
- Author(s)
  Ishiyama Tatsuya、Tahara Tahei、Morita Akihiro
- Journal Title
  
  Journal of the American Chemical Society
  
  Volume: 144 Issue: 14 Pages: 6321-6325
- DOI
  10.1021/jacs.1c13336
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368, KAKENHI-PROJECT-23K21095
[Journal Article] Development of efficient computational analysis of difference infrared and Raman spectroscopies2022
- Author(s)
  Hirano Tomonori、Yazawa Naoya、Wang Lin、Morita Akihiro
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 157 Issue: 12 Pages: 124105-124105
- DOI
  10.1063/5.0108934
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265
[Journal Article] Correction to: Quadrupole Contributions from Interface and Bulk2022
- Author(s)
  Morita Akihiro
- Journal Title
  
  Lecture Notes in Chemistry
  
  Volume: 97 Pages: C1-C2
- DOI
  10.1007/978-981-13-1607-4_12
- ISBN
  9789811316067, 9789811316074
- Open Access
- Data Source
  KAKENHI-PROJECT-18H05265
[Journal Article] Boundary effects and quadrupole contribution in sum frequency generation spectroscopy2022
- Author(s)
  Hirano Tomonori、Morita Akihiro
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 156 Issue: 15 Pages: 154109-154109
- DOI
  10.1063/5.0076400
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Correction to “Dispersion of Complex Refractive Indices for Intense Vibrational Bands. II. Implication to Sum Frequency Generation Spectroscopy”2022
- Author(s)
  L. Wang、R. Murata、K. Inoue、S. Ye、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 126 Issue: 10 Pages: 2143-2143
- DOI
  10.1021/acs.jpcb.2c01098
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Correction to “Dispersion of Complex Refractive Indices for Intense Vibrational Bands. I. Quantitative Spectra”2022
- Author(s)
  R. Murata、K. Inoue、L. Wang、S. Ye、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 126 Issue: 10 Pages: 2142-2142
- DOI
  10.1021/acs.jpcb.2c01314
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Reply to the ‘Comment on “Bi-layering at ionic liquid surfaces: a sum-frequency generation vibrational spectroscopy- and molecular dynamics simulation-based study”’ by M. Deutsch, O. M. Magnussen, J. Haddad, D. Pontoni, B. M. Murphy and B. M. Ocko, Phys. Chem. Chem. Phys., 2021, DOI: 10.1039/D0CP04882H2021
- Author(s)
  T. Iwahashi、T. Ishiyama、Y. Sakai、A. Morita、D. Kim、Y. Ouchi
- Journal Title
  
  Physical Chemistry Chemical Physics
  
  Volume: 23 Issue: 8 Pages: 5028-5030
- DOI
  10.1039/d1cp00171j
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Dispersion of Complex Refractive Indices for Intense Vibrational Bands. I. Quantitative Spectra2021
- Author(s)
  R. Murata、K. Inoue、L. Wang、S. Ye、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 125 Issue: 34 Pages: 9794-9803
- DOI
  10.1021/acs.jpcb.1c06189
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Exploration of Gas-Liquid Interfaces for Liquid Water and Methanol Using Extreme Ultraviolet Laser Photoemission Spectroscopy2021
- Author(s)
  Y. Yamamoto、T. Ishiyama、A. Morita、T. Suzuki
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 125 Issue: 37 Pages: 10514-10526
- DOI
  10.1021/acs.jpcb.1c04765
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368, KAKENHI-PROJECT-21H04675, KAKENHI-PROJECT-21H04970, KAKENHI-PROJECT-23K21095
[Journal Article] Dispersion of Complex Refractive Indices for Intense Vibrational Bands. II. Implication to Sum Frequency Generation Spectroscopy2021
- Author(s)
  L. Wang、R. Murata、K. Inoue、S. Ye、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 125 Issue: 34 Pages: 9804-9810
- DOI
  10.1021/acs.jpcb.1c06190
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Recent progress in simulating microscopic ion transport mechanisms at liquid-liquid interfaces2021
- Author(s)
  A. Morita、A. Koizumi、T. Hirano
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 154 Issue: 8 Pages: 080901-080901
- DOI
  10.1063/5.0039172
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Development of quadrupole susceptibility automatic calculator in sum frequency generation spectroscopy and application to methyl C-H vibrations2020
- Author(s)
  W. Mori、L. Wang、Y. Sato、A. Morita
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 153 Issue: 17 Pages: 174705-174705
- DOI
  10.1063/5.0026341
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Quadrupole Contribution of C=O Vibrational Band in Sum Frequency Generation Spectra of Organic Carbonates2020
- Author(s)
  Lin Wang, Wataru Mori, Akihiro Morita*, Masato Kondoh, Masanari Okuno, and Taka-aki Ishibashi*
- Journal Title
  
  The Journal of Physical Chemistry Letters
  
  Volume: 11 Issue: 20 Pages: 8527-8531
- DOI
  10.1021/acs.jpclett.0c02453
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19K05362, KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Electron Transfer Mechanism at the Oil/Water Interface Revealed by Multidimensional Free Energy Calculations2020
- Author(s)
  T. Hirano、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 124 Issue: 18 Pages: 3811-3827
- DOI
  10.1021/acs.jpcb.0c01467
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] In Situ Monitoring of the Unsaturated Phospholipid Monolayer Oxidation in Ambient Air by HD-SFG Spectroscopy2020
- Author(s)
  K. Inoue、C. Takada、L. Wang、A. Morita、S. Ye
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 124 Issue: 25 Pages: 5246-5250
- DOI
  10.1021/acs.jpcb.0c03408
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368, KAKENHI-PROJECT-19K15496
[Journal Article] Bi-layering at ionic liquid surfaces: a sum-frequency generation vibrational spectroscopy- and molecular dynamics simulation-based study2020
- Author(s)
  Iwahashi Takashi、Ishiyama Tatsuya、Sakai Yasunari、Morita Akihiro、Kim Doseok、Ouchi Yukio
- Journal Title
  
  Physical Chemistry Chemical Physics
  
  Volume: 22 Issue: 22 Pages: 12565-12576
- DOI
  10.1039/d0cp01219j
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19K05539, KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Large-Scale Parallel Implementation of Hartree?Fock Exchange Energy on Real-Space Grids Using 3D-Parallel Fast Fourier Transform2020
- Author(s)
  H. Takahashi、S. Sakuraba、A. Morita
- Journal Title
  
  Journal of Chemical Information and Modeling
  
  Volume: 60 Issue: 3 Pages: 1376-1389
- DOI
  10.1021/acs.jcim.9b01063
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-17K05138
[Journal Article] Revealing Transient Shuttling Mechanism of Catalytic Ion Transport through Liquid?Liquid Interface2020
- Author(s)
  A. Koizumi、H. Tahara、T. Hirano、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry Letters
  
  Volume: 11 Issue: 4 Pages: 1584-1588
- DOI
  10.1021/acs.jpclett.9b03742
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265
[Journal Article] Refractive index of nanoconfined water reveals its anomalous physical properties2020
- Author(s)
  T. H. H. Le、A. Morita、T. Tanaka
- Journal Title
  
  Nanoscale Horizons
  
  Volume: 5 Issue: 6 Pages: 1016-1024
- DOI
  10.1039/d0nh00180e
- Peer Reviewed / Open Access / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368, KAKENHI-PROJECT-18H03889
[Journal Article] Comment on “Toward Unraveling the Puzzle of Sum Frequency Generation Spectra at Interface of Aqueous Methanol Solution: Effects of Concentration-Dependent Hyperpolarizability”2020
- Author(s)
  T. Ishiyama、S. Takagi、T. Hirano、L. Wang、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 124 Issue: 45 Pages: 25160-25162
- DOI
  10.1021/acs.jpcc.0c06234
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-20H00368
[Journal Article] Effect of Frequency-Dependent Fresnel Factor on the Vibrational Sum Frequency Generation Spectra for Liquid/Solid Interfaces2019
- Author(s)
  Wang Lin、Nihonyanagi Satoshi、Inoue Ken-ichi、Nishikawa Kei、Morita Akihiro、Ye Shen、Tahara Tahei
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 123 Issue: 25 Pages: 15665-15673
- DOI
  10.1021/acs.jpcc.9b04043
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19K15496, KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-17H01879
[Journal Article] Nonlinear spectroscopy and interfacial structure and dynamics2019
- Author(s)
  A. Benderskii、A. Morita
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 151 Issue: 15 Pages: 150401-150401
- DOI
  10.1063/1.5129103
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Journal Article] Calculation of solvation free energy utilizing a constrained QM/MM approach combined with a theory of solutions2019
- Author(s)
  Takahashi Hideaki、Kambe Hiroyuki、Morita Akihiro
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 150 Issue: 11 Pages: 114109-114109
- DOI
  10.1063/1.5089199
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17K05138, KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-26288003
[Journal Article] Molecular structure and vibrational spectra at water/poly(2-methoxyethylacrylate) and water/poly(methyl methacrylate) interfaces: A molecular dynamics simulation study2019
- Author(s)
  S. Kishinaka、A. Morita、T.Ishiyama
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 150 Issue: 4 Pages: 044707-044707
- DOI
  10.1063/1.5074144
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-26288003
[Journal Article] Nuclear Quantum Effect on the χ(2) Band Shape of Vibrational Sum Frequency Generation Spectra of Normal and Deuterated Water Surfaces2019
- Author(s)
  T. Ishiyama、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry Letters
  
  Volume: 10 Issue: 17 Pages: 5070-5075
- DOI
  10.1021/acs.jpclett.9b02069
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-16H04095
[Journal Article] Topologically disordered mesophase at the topmost surface layer of crystalline ice between 120 and 200 K2019
- Author(s)
  T. Sugimoto, Y. Otsuki, T. Ishiyama, A. Morita, K. Watanabe, and Y. Matsumoto
- Journal Title
  
  Physical Review B
  
  Volume: 99 Issue: 12 Pages: 121402-121402
- DOI
  10.1103/physrevb.99.121402
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17H06087, KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-16H02249, KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-16H06029, KAKENHI-PROJECT-17J08352, KAKENHI-PROJECT-26288003
[Journal Article] Role of the Photosystem II as an Environment in the Oxidation Free Energy of the Mn Cluster from S1 to S22019
- Author(s)
  H. Takahashi、D. Suzuoka、S. Sakuraba、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 123 Issue: 33 Pages: 7081-7091
- DOI
  10.1021/acs.jpcb.9b03831
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-17K05138
[Journal Article] Metamaterials-Enhanced Infrared Spectroscopic Study of Nanoconfined Molecules by Plasmonics?Nanofluidics Hydrid Device2018
- Author(s)
  Le Thu H. H.、Morita Akihiro、Mawatari Kazuma、Kitamori Takehiko、Tanaka Takuo
- Journal Title
  
  ACS Photonics
  
  Volume: 5 Issue: 8 Pages: 3179-3188
- DOI
  10.1021/acsphotonics.8b00398
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-17H05471, KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-26288003, KAKENHI-PROJECT-18H03889
[Journal Article] Origin of the Overpotential for the Oxygen Evolution Reaction on a Well-Defined Graphene Electrode Probed by in Situ Sum Frequency Generation Vibrational Spectroscopy2018
- Author(s)
  Q. Peng、J. Chen、H. Ji、A. Morita、S. Ye
- Journal Title
  
  Journal of the American Chemical Society
  
  Volume: 140 Issue: 46 Pages: 15568-15571
- DOI
  10.1021/jacs.8b08285
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-17H01879, KAKENHI-PROJECT-26288003
[Journal Article] 液液界面でのイオン輸送の分子機構2018
- Author(s)
  森田明弘
- Journal Title
  
  Colloid & Interface Communication
  
  Volume: 4 Pages: 26-28
- NAID
  40021626163
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26288003
[Journal Article] 液液界面でのイオン輸送の分子機構2018
- Author(s)
  森田明弘
- Journal Title
  
  Colloid & Interface Communication
  
  Volume: 43 Pages: 26-28
- NAID
  40021626163
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003
[Journal Article] Electrolyte and Temperature Effects on Third-Order Susceptibility in Sum-Frequency Generation Spectroscopy of Aqueous Salt Solutions2018
- Author(s)
  T. Joutsuka、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 122 Issue: 21 Pages: 11407-11413
- DOI
  10.1021/acs.jpcc.8b02445
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-26288003
[Journal Article] Effects of third-order susceptibility in sum frequency generation spectra: a molecular dynamics study in liquid water2018
- Author(s)
  Joutsuka Tatsuya、Hirano Tomonori、Sprik Michiel、Morita Akihiro
- Journal Title
  
  Physical Chemistry Chemical Physics
  
  Volume: 20 Issue: 5 Pages: 3040-3053
- DOI
  10.1039/c7cp01978e
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26288003, KAKENHI-PLANNED-25104003
[Journal Article] Molecular dynamics study of structure and vibrational spectra at zwitterionoic lipid/aqueous KCl, NaCl, and CaCl2 solution interfaces2018
- Author(s)
  Ishiyama Tatsuya、Shirai Shinnosuke、Okumura Tomoaki、Morita Akihiro
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 148 Issue: 22 Pages: 222801-222801
- DOI
  10.1063/1.5006543
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-18H05265
[Journal Article] Microscopic Investigation of Ethylene Carbonate Interface: A Molecular Dynamics and Vibrational Spectroscopic Study2018
- Author(s)
  L. Wang, L. Xin, T. Ishiyama, Q. Peng, S. Ye, A. Morita
- Journal Title
  
  Acta Phys. Chim. Sin.
  
  Volume: 34 Issue: 10 Pages: 1124-1135
- DOI
  10.3866/pku.whxb201801291
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-17H01879, KAKENHI-PROJECT-26288003
[Journal Article] Structure at the air/water interface in the presence of phenol: a study using heterodyne-detected vibrational sum frequency generation and molecular dynamics simulation2018
- Author(s)
  Kusaka Ryoji、Ishiyama Tatsuya、Nihonyanagi Satoshi、Morita Akihiro、Tahara Tahei
- Journal Title
  
  Physical Chemistry Chemical Physics
  
  Volume: 20 Issue: 5 Pages: 3002-3009
- DOI
  10.1039/c7cp05150f
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26288003, KAKENHI-PLANNED-25104003, KAKENHI-PLANNED-25104005, KAKENHI-PROJECT-16H04095
[Journal Article] Bulk Contributions Modulate the Sum-Frequency Generation Spectra of Water on Model Sea-Spray Aerosols2018
- Author(s)
  S. K. Reddy 、R. Thiraux、B. A. Wellen Rudd 、L. Lin、T. Adel 、T. Joutsuka 、F. M. Geiger 、H. C. Allen 、A. Morita、F. Paesani
- Journal Title
  
  Chem
  
  Volume: 4 Issue: 7 Pages: 1629-1644
- DOI
  10.1016/j.chempr.2018.04.007
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-26288003
[Journal Article] Singularity-free constraint on molecular dynamics beyond Lagrange multiplier2018
- Author(s)
  T. Hirano 、L. Wang、A. Morita
- Journal Title
  
  Molecular Simulation
  
  Volume: 44 Issue: 12 Pages: 965-972
- DOI
  10.1080/08927022.2018.1467012
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-26288003
[Journal Article] A simple and effective solution to the constrained QM/MM simulations2018
- Author(s)
  Takahashi Hideaki、Kambe Hiroyuki、Morita Akihiro
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 148 Issue: 13 Pages: 134119-134119
- DOI
  10.1063/1.5019874
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17K05138, KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-26288003
[Journal Article] Hydrated Ion Clusters in Hydrophobic Liquid: Equilibrium Distribution, Kinetics, and Implications2018
- Author(s)
  L. J. Wang、N. Kikkawa 、A. Morita
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 122 Issue: 13 Pages: 3562-3571
- DOI
  10.1021/acs.jpcb.7b10740
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18H05265, KAKENHI-PROJECT-26288003
[Journal Article] Theoretical and Experimental Examination on SFG Polarization Analysis at Acetonitrile-Water Solution Surfaces2017
- Author(s)
  Kengo Saito, Qiling Peng, Lin Qiao, Lin Wang, Tatsuya Joutsuka, Tatsuya Ishiyama, Shen Ye, and Akihiro Morita
- Journal Title
  
  Phys. Chem. Chem. Phys.
  
  Volume: 19 Issue: 13 Pages: 8941-8961
- DOI
  10.1039/c6cp08856b
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-26288003, KAKENHI-PROJECT-17H01879
[Journal Article] Unveiling subsurface hydrogen-bond structure of hexagonal water ice2017
- Author(s)
  Otsuki Yuji、Sugimoto Toshiki、Ishiyama Tatsuya、Morita Akihiro、Watanabe Kazuya、Matsumoto Yoshiyasu
- Journal Title
  
  Physical Review B
  
  Volume: 96 Issue: 11 Pages: 115405-115405
- DOI
  10.1103/physrevb.96.115405
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26288003, KAKENHI-PUBLICLY-16H00937, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-16H02249, KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-17J08352
[Journal Article] Drastic Compensation of the Electronic and Solvation Effects on the ATP Hydrolysis Revealed through a Large-Scale QM/MM Simulations Combined with a Theory of Solutions2017
- Author(s)
  Hideaki Takahashi, Satoru Umino, Yuuji Miki, Ryosuke Ishizuka, Akihiro Morita, Makoto Suzuki, and Nobuyuki Matubayasi
- Journal Title
  
  J. Phys. Chem. B
  
  Volume: 121 Issue: 10 Pages: 2279-2287
- DOI
  10.1021/acs.jpcb.7b00637
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26240045, KAKENHI-PROJECT-26288003, KAKENHI-PROJECT-16K13860, KAKENHI-PROJECT-15K13550, KAKENHI-PROJECT-17K05138
[Journal Article] Theoretical Investigation of C-H Vibrational Spectroscopy. 1. Modeling of Methyl and Methylene Groups of Ethanol with Different Conformers2017
- Author(s)
  Wang Lin、Ishiyama Tatsuya、Morita Akihiro
- Journal Title
  
  The Journal of Physical Chemistry A
  
  Volume: 121 Issue: 36 Pages: 6687-6700
- DOI
  10.1021/acs.jpca.7b05320
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26288003, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-16H04095
[Journal Article] Experimental and Theoretical Evidence for Bilayer-by-Bilayer Surface Melting of Crystalline Ice2017
- Author(s)
  M. Alejandra Sanchez, Tanja Kling, Tatsuya Ishiyama, Marc-Jan van Zadel, Patrick J. Bisson, Markus Mezger, Mara Nikola Jochum, Jenee D. Cyran, Wilbert J. Smit, Huib J. Bakker, Mary Jane Shultz, Akihiro Morita, Davide Donadio, Yuki Nagata, Mischa Bonn, Ellen H. G. Backus
- Journal Title
  
  Proc. Natl. Acad. Sci.
  
  Volume: 114 Issue: 2 Pages: 227-232
- DOI
  10.1073/pnas.1612893114
- Peer Reviewed / Acknowledgement Compliant / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-26288003
[Journal Article] A QM/MM study on the correlation between the polarisations of and electrons in a hydrated benzene2017
- Author(s)
  Suzuoka Daiki、Takahashi Hideaki、Morita Akihiro
- Journal Title
  
  Molecular Simulation
  
  Volume: 43 Issue: 13-16 Pages: 1209-1217
- DOI
  10.1080/08927022.2017.1350661
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17K05138, KAKENHI-PROJECT-26288003, KAKENHI-PLANNED-25104003
[Journal Article] Computational Analysis of Vibrational Sum Frequency Generation Spectroscopy2017
- Author(s)
  T. Ishiyama and A. Morita
- Journal Title
  
  The Annual Review of Physical Chemistry
  
  Volume: 68 Issue: 1 Pages: 1-22
- DOI
  10.1146/annurev-physchem-052516-044806
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-26288003, KAKENHI-PLANNED-25104003
[Journal Article] 水表面の不均一化学の分子シミュレーション2017
- Author(s)
  森田明弘
- Journal Title
  
  大気化学研究
  
  Volume: 36
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003
[Journal Article] Free Energy Calculation2017
- Author(s)
  Akihiro Morita
- Journal Title
  
  Elsevier Reference Module in Chemistry, Molecular Sciences and Chemical Engineering
  
  Volume: -
- DOI
  10.1016/b978-0-12-409547-2.12786-6
- ISBN
  9780124095472
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] 水表面の不均一化学の分子シミュレーション2017
- Author(s)
  森田　明弘
- Journal Title
  
  大気化学研究
  
  Volume: 36
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26288003
[Journal Article] Theoretical Investigation of C-H Vibrational Spectroscopy. 2. Unified Assignment Method of IR, Raman, and Sum Frequency Generation Spectra of Ethanol2017
- Author(s)
  Wang Lin、Ishiyama Tatsuya、Morita Akihiro
- Journal Title
  
  The Journal of Physical Chemistry A
  
  Volume: 121 Issue: 36 Pages: 6701-6712
- DOI
  10.1021/acs.jpca.7b05378
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26288003, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-16H04095
[Journal Article] Efficient Spectral Diffusion at the Air/Water Interface Revealed by Femtosecond Time-Resolved Heterodyne-Detected Vibrational Sum Frequency Generation Spectroscopy2016
- Author(s)
  Ken-ichi Inoue, Tatsuya Ishiyama, Satoshi Nihonyanagi, Shoichi Yamaguchi, Akihiro Morita, and Tahei Tahara
- Journal Title
  
  J. Phys. Chem. Lett.
  
  Volume: 7 Issue: 10 Pages: 1811-1815
- DOI
  10.1021/acs.jpclett.6b00701
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PLANNED-25104005, KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-26288003
[Journal Article] Hydrogen Bonding Structure at Zwitterionic Lipid/Water Interface2016
- Author(s)
  Tatsuya Ishiyama, Daichi Terada, and Akihiro Morita
- Journal Title
  
  J. Phys. Chem. Lett.
  
  Volume: 7 Issue: 2 Pages: 216-220
- DOI
  10.1021/acs.jpclett.5b02567
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25410001, KAKENHI-PROJECT-26288003
[Journal Article] Condensed Phase QM/MM Simulations Utilizing the Exchange Core Functions to Describe Exchange Repulsions at the QM Boundary Region2016
- Author(s)
  Satoru Umino, Hideaki Takahashi, and Akihiro Morita
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 145 Issue: 8 Pages: 084107-084107
- DOI
  10.1063/1.4961373
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] Efficient Computation of Difference Vibrational Spectra in Isothermal-Isobaric Ensemble2016
- Author(s)
  Tatsuya Joutsuka and Akihiro Morita
- Journal Title
  
  J. Phys. Chem. B
  
  Volume: 120 Issue: 43 Pages: 11229-11238
- DOI
  10.1021/acs.jpcb.6b07121
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] Computational Study of Effect of Water Finger on Ion Transport through Water-Oil Interface2016
- Author(s)
  Nobuaki Kikkawa, Lingjian Wang, and Akihiro Morita
- Journal Title
  
  J. Chem. Phys
  
  Volume: 145 Issue: 1
- DOI
  10.1063/1.4954774
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] Surface Structure of Organic Carbonate Liquids Investigated by Molecular Dynamics Simulation and Sum Frequency Generation Spectroscopy2016
- Author(s)
  Lin Wang, Qiling Peng, Shen Ye, and Akihiro Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 120 Issue: 28 Pages: 15185-15197
- DOI
  10.1021/acs.jpcc.6b03935
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] Bend Vibration of Surface Water Investigated by Heterodyne-Detected Sum Frequency Generation and Theoretical Study: Dominant Role of Quadrupole2016
- Author(s)
  Achintya Kundu, Shogo Tanaka, Tatsuya Ishiyama, Mohammed Ahmed, Ken-ichi Inoue, Satoshi Nihonyanagi, Hiromi Sawai, Shoichi Yamaguchi, Akihiro Morita, and Tahei Tahara
- Journal Title
  
  J. Phys.Chem. Lett
  
  Volume: 7 Issue: 13 Pages: 2597-2601
- DOI
  10.1021/acs.jpclett.6b00657
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PLANNED-25104005, KAKENHI-PROJECT-16H04095, KAKENHI-PROJECT-26288003
[Journal Article] Improved Theory of Difference Vibrational Spectroscopy and Application to Water2016
- Author(s)
  Tatsuya Joutsuka and Akihiro Morita
- Journal Title
  
  J. Chem. Theory Comput.
  
  Volume: 12 Issue: 10 Pages: 5026-5036
- DOI
  10.1021/acs.jctc.6b00697
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] Liquid/Liquid Interface Layering of 1-butanol and [bmim]PF6 Ionic Liquid: A Nonlinear Vibrational Spectroscopy and Molecular Dynamics Simulation Study2015
- Author(s)
  Takashi Iwahashi, Tatsuya Ishiyama, Yasunari Sakai,Akihiro Morita, Doseok Kime and Yukio Ouchi
- Journal Title
  
  Phys. Chem. Chem. Phys.
  
  Volume: 17 Issue: 38 Pages: 24587-24597
- DOI
  10.1039/c5cp03307a
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26248004, KAKENHI-PROJECT-15H06200, KAKENHI-PROJECT-25410001, KAKENHI-PROJECT-26288003
[Journal Article] Surface Structure of Methanol/Water Solutions via Sum-Frequency Orientational Analysis and Molecular Dynamics Simulation2015
- Author(s)
  Takashi Ishihara, Tatsuya Ishiyama, and Akihiro Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 119 Issue: 18 Pages: 9879-9889
- DOI
  10.1021/acs.jpcc.5b01197
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25410001, KAKENHI-PROJECT-26288003
[Journal Article] Construction of Exchange Repulsion in Terms of the Wave Functions at QM/MM Boundary Region2015
- Author(s)
  Hideaki Takahashi, Satoru Umino, and Akihiro Morita
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 143 Issue: 8 Pages: 084104-084114
- DOI
  10.1063/1.4928762
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] Microscopic Barrier Mechanism of Ion Transport through Liquid-Liquid Interface2015
- Author(s)
  Nobuaki Kikkawa, Lingjian Wang, and Akihiro Morita
- Journal Title
  
  J. Am. Chem. Soc.
  
  Volume: 137 Issue: 25 Pages: 8022-8025
- DOI
  10.1021/jacs.5b04375
- Peer Reviewed / Acknowledgement Compliant / Open Access
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-13J02345, KAKENHI-PROJECT-26288003
[Journal Article] Computation of the Free Energy due to Electron Density Fluctuation of a Solute in Solution: A QM/MM Method with Perturbation Approach Combined with a Theory of Solutions2014
- Author(s)
  Daiki Suzuoka, Hideaki Takahashi, and Akihiro Morita
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 140 Issue: 13 Pages: 134111-134111
- DOI
  10.1063/1.4870037
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25620004, KAKENHI-PROJECT-26288003
[Journal Article] Theoretical Studies of Structures and Vibrational Sum Frequency Generation Spectra at Aqueous Interfaces2014
- Author(s)
  T. Ishiyama, T. Imamura, A. Morita
- Journal Title
  
  Chem. Rev
  
  Volume: (in press) Issue: 14 Pages: 144109-144109
- DOI
  10.1063/1.4870523
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25410001, KAKENHI-PROJECT-26288003
[Journal Article] 4. 電極界面におけるイオンの水和殻崩壊過程の時間分解赤外分光観察2014
- Author(s)
  山方啓, 大澤雅俊, 森田明弘
- Journal Title
  
  Electrochemistry
  
  Volume: 82 Issue: 9 Pages: 771-776
- DOI
  10.5796/electrochemistry.82.771
- NAID
  130004688662
- ISSN
  1344-3542, 2186-2451
- Language
  English
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23000009, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003, KAKENHI-PROJECT-23360360
[Journal Article] Molecular Dynamics Analysis of NaOH Aqueous Solution Surface and the Sum Frequency Generation Spectra: Is Surface OH- Detected by SFG Spectroscopy?2014
- Author(s)
  Takako Imamura, Tatsuya Ishiyama, and Akihiro Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 118 Issue: 50 Pages: 29017-29027
- DOI
  10.1021/jp502890s
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25410001, KAKENHI-PROJECT-26288003
[Journal Article] Surface Acidity of Water Probed by Free Energy Calculation for Trimet hylamine Protonation2014
- Author(s)
  Yusuke Tabe, Nobuaki Kikkawa, Hideaki Takahashi, and Akihiro Morita.
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 118(2) Issue: 2 Pages: 977-988
- DOI
  10.1021/jp4078882
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-13J02345, KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25620004
[Journal Article] Computational Molecular Science of Liquid Interfaces2014
- Author(s)
  森田明弘
- Journal Title
  
  Mol. Sci.
  
  Volume: 8 Issue: 1 Pages: A0070
- DOI
  10.3175/molsci.8.A0070
- NAID
  130004688038
- ISSN
  1881-8404
- Language
  Japanese
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] Theoretical Studies of Structures and Vibrational Sum Frequency Generation Spectra at Aqueous Interfaces2014
- Author(s)
  Tatsuya Ishiyama, Takako Imamura, and Akihiro Morita.
- Journal Title
  
  Chemical Reviews
  
  Volume: (印刷中)(掲載確定) Issue: 17 Pages: 8447-8470
- DOI
  10.1021/cr4004133
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-13J02328, KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25410001, KAKENHI-PROJECT-26288003
[Journal Article] Reply to"Commenton 'Surface Acidity of Water Probed by Free Energy Calculation for Trimethylamine Protonation'"2014
- Author(s)
  Yusuke Tabe, Nobuaki Kikkawa, Hideaki Takahashi, and Akihiro Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 118(5) Issue: 5 Pages: 2895-2895
- DOI
  10.1021/jp5005083
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-13J02345, KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003
[Journal Article] Erratum: `Theory and Efficient Computation of Differential Vibrational Spectra' [J. Chem. Phys., 140, 144109 (2014)]2014
- Author(s)
  Suguru Sakaguchi, Tatsuya Ishiyama, and Akihiro Morita
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 141 Issue: 14 Pages: 149901-149901
- DOI
  10.1063/1.4897417
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-26288003
[Journal Article] A Direct Evidence of Vibrationally Delocalized Response at Ice Surface2014
- Author(s)
  Tatsuya Ishiyama and Akihiro Morita
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 141 Issue: 18
- DOI
  10.1063/1.4895547
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25410001, KAKENHI-PROJECT-26288003
[Journal Article] Tip-Enhanced Raman Spectroscopy of 4,4'-Bipyridine and 4,4'-Bipyridine N, N'-Dioxide Adsorbedon Gold Thin Films2013
- Author(s)
  Izabela I. Rzeznicka, Hideyuki Horino, Nobuaki Kikkawa, Suguru Sakaguchi, Akihiro Morita, Satoshi Takahashi, Tadahiro Komeda, Hiroshi Fukumura, Taro Yamada, and Maki Kawai
- Journal Title
  
  Surf. Sci.
  
  Volume: 617 Pages: 1-9
- DOI
  10.1016/j.susc.2013.08.010
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-13J02345, KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003, KAKENHI-PLANNED-25104007, KAKENHI-PROJECT-25390001
[Journal Article] Real-Time Observation of the Destruction of Hydration Shells2013
- Author(s)
  Akira Yamakata, Eiji Soeta, Tatsuya Ishiyama, Masatoshi Osawa, and Akihiro Morita
- Journal Title
  
  J. Am. Chem. Soc.
  
  Volume: 135 Issue: 40 Pages: 15033-15039
- DOI
  10.1021/ja408326d
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-23000009, KAKENHI-PROJECT-23360360, KAKENHI-PROJECT-24550143, KAKENHI-PLANNED-25104003, KAKENHI-PROJECT-25410001
[Journal Article] Molecular Dynamics Study of Water Transfer at Supercooled Sulfuric Acid Solution Surface Covered with Butanol2013
- Author(s)
  S. Sakaguchi, A. Morita
- Journal Title
  
  J. Phys. Chem. A
  
  Volume: 117 Issue: 22 Pages: 4602-4610
- DOI
  10.1021/jp310305a
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003
[Journal Article] A Molecular Dynamics Study on Inner Pressure of Microbubbles in Liquid Argon and Water2013
- Author(s)
  Hideaki Takahashi and Akihiro Morita
- Journal Title
  
  Chem. Phys. Lett.
  
  Volume: 573 Pages: 35-40
- DOI
  10.1016/j.cplett.2013.04.041
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003
[Journal Article] Computational Analysis of the Quadrupole Contribution in the Second-Harmonic Generation Spectroscopy for the Water/Vapor Interface2013
- Author(s)
  K. Shiratori, S. Yamaguchi, T. Tahara, A. Morita
- Journal Title
  
  J. Chem. Phys
  
  Volume: 138 Issue: 15 Pages: 64704-64704
- DOI
  10.1063/1.4802916
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PLANNED-25104003
[Journal Article] Molecular Dynamics Study of Phase Transfer Catalyst for Ion Transfer through Water-Chloroform Interface2012
- Author(s)
  Nobuaki Kikkawa, Tatsuya Ishiyama, Akihiro Morita
- Journal Title
  
  Chem.Phys.Lett.
  
  Volume: 534 Pages: 19-22
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Origin of Vibrational Spectroscopic Response at Ice Surface2012
- Author(s)
  T. Ishiyama, H. Takahashi, A. Morita
- Journal Title
  
  J. Phys. Chem. Lett
  
  Volume: 3 Issue: 20 Pages: 3001-3006
- DOI
  10.1021/jz3012723
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22750003
[Journal Article] SFGスペクトルのシミュレーション2012
- Author(s)
  森田明弘
- Journal Title
  
  分光研究
  
  Volume: 61 Pages: 236-242
- NAID
  10031131712
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Vibrational Spectrum at Water Surface : A Hybrid Quantum Mechanics/Molecular Mechanics Molecular Dynamics Approach2012
- Author(s)
  T. Ishiyama, H. Takahashi, A. Morita
- Journal Title
  
  J. Phys. : Condens. Matter
  
  Volume: 24 Issue: 12 Pages: 124107-124107
- DOI
  10.1088/0953-8984/24/12/124107
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PUBLICLY-23118701
[Journal Article] Theory of Quadrupole Contributions from Interface and Bulk in Second-Order Optical Processes2012
- Author(s)
  K. Shiratori, A. Morita
- Journal Title
  
  Bull. Chem. Soc. Jpn
  
  Volume: 85 Issue: 10 Pages: 1061-1076
- DOI
  10.1246/bcsj.20120167
- NAID
  130004059041
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Molecular Dynamics Study of Phase Transfer Catalyst for Ion Transfer through Water-Chloroform Interface2012
- Author(s)
  Nobuaki Kikkawa, Tatsuya Ishiyama, and Akihiro Morita
- Journal Title
  
  Chem. Phys. Lett.
  
  Volume: 534 Pages: 19-22
- DOI
  10.1016/j.cplett.2012.03.027
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Development of a Methodology to Compute Solvation Free Energies on the Basis of the Theory of Energy Representation for Solutions Represented with a Polarizable Force Field2012
- Author(s)
  Daiki Suzuoka, Hideaki Takahashi, Tatsuya Ishiyama, and Akihiro Morita
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 137 Issue: 21 Pages: 214503-214503
- DOI
  10.1063/1.4769075
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22750003, KAKENHI-PUBLICLY-23118701
[Journal Article] Surface Structures of NaF and Na_2SO_4 Aqueous Solutions : Specific Effects of Hard Ions on Surface Vibrational Spectra2012
- Author(s)
  T. Imamura, Y. Mizukoshi, T. Ishiyama, A. Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 116 Issue: 20 Pages: 11082-11090
- DOI
  10.1021/jp3019777
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22750003
[Journal Article] Nonlinear Vibrational Spectroscopic Studies on the Ionic Liquid ([C_nmim]TFSA(n=4,8))/Water Interfaces2012
- Author(s)
  Takashi Iwahashi, Yasunari Sakai, Doseok Kim, Tatsuya Ishiyama, Akihiro Morita, Yukio Ouchi
- Journal Title
  
  Faraday Discuss.
  
  Volume: 154 Pages: 289-301
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Mechanisms of Sum Frequency Generation from Liquid Benzene : Symmetry Breaking at Interface and Bulk Contribution2012
- Author(s)
  T. Kawaguchi, K. Shiratori, Y. Henmi, T. Ishiyama, A. Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 116 Issue: 24 Pages: 13169-13182
- DOI
  10.1021/jp302684q
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22750003
[Journal Article] Mass Accommodation Mechanism of Water through Monolayer Films at Water/Vapor Interface2012
- Author(s)
  Suguru Sakaguchi and Akihiro Morita
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 137 Issue: 6 Pages: 64701-64701
- DOI
  10.1063/1.4740240
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Simple and exact approach to the electronic polarization effect on the solvation free energy: Formulation for QM/MM system and its applications to aqueous solutions2012
- Author(s)
  H. Takahashi, A. Omi, A. Morita, and N. Matubayasi
- Journal Title
  
  J. Chem. Phys
  
  Volume: 136 Issue: 21 Pages: 214503-214503
- DOI
  10.1063/1.4722347
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20118002, KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-21300111, KAKENHI-ORGANIZER-20118001, KAKENHI-PUBLICLY-23118701
[Journal Article] Molecular Dynamics Simulations of Surface-Specific Bonding of the Hydrogen Network of Water : A Solution to the Low Sum-Frequency Spectra2012
- Author(s)
  T. Ishiyama, H. Takahashi, A. Morita
- Journal Title
  
  Phys. Rev. B
  
  Volume: 86 Issue: 3
- DOI
  10.1103/physrevb.86.035408
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22750003
[Journal Article] Interfacial Structures and Vibrational Spectra at Liquid/Liquid Boundaries : Molecular Dynamics Study of Water/Carbon Tetrachloride and Water/1,2-Dichloroethane Interfaces2012
- Author(s)
  T. Ishiyama, Y. Sato, A. Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 116 Issue: 40 Pages: 21439-21446
- DOI
  10.1021/jp3073365
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22750003
[Journal Article] Unified Molecular View of Air/Wat er Interface Based on Experimental and Theoretical X^<(2)> Spectra of Isotopically Diluted Water Surface2011
- Author(s)
  S. NIHONYANAGI, T. ISHIYAMA, T. K. LEE, S. YAMAGUTHI, M. BONN, A. MORITA, T. TAHARA
- Journal Title
  
  J. Am. Chem. Soc.
  
  Volume: 133
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19056009
[Journal Article] Molecular Dynamics Simulation of Liquid Methanol.I.Molecular Modeling including C-H Vibration and Fermi Resonance2011
- Author(s)
  Tatsuya Ishiyama, Vladimir V.Sokolov, Akihiro Morita
- Journal Title
  
  J.Chem.Phys.
  
  Volume: 134
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Molecular Dynamics Simulation of Liquid Methanol.II.Unified Assignment of Infrared, Raman, and Sum Frequency Generation Vibrational Spectra in Methyl C-H Stretching Region2011
- Author(s)
  Tatsuya Ishiyama, Vladimir V.Sokolov, Akihiro Morita
- Journal Title
  
  J.Chem.Phys.
  
  Volume: 134
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Molecular Dynamics Simulation of Sum Frequency Generation Spectra of Aqueous Sulfuric Acid Solution2011
- Author(s)
  Tatsuya Ishiyama, Akihiro Morita
- Journal Title
  
  J.Phys.Chem.C
  
  Volume: 115/28 Pages: 13704-13716
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Energetic Origin of Proton Affinity to the Air/Water Interface2011
- Author(s)
  Hideaki Takahashi, Kunihiro Maruyama, Yasuhito Karino, Akihiro Morita, Masayoshi Nakano, Pavel Jungwirth, Nobuyuki Matubayasi
- Journal Title
  
  J.Phys.Chem.B
  
  Volume: 115/16 Pages: 4745-4751
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Unified Molecular View of Air/Water Interface Based on Experimental and Theoretical χ^(2) Spectra of Isotopically Diluted, Water Surface2011
- Author(s)
  Satoshi NIHONYANAGI, Tatsuya ISHIYAMA, Touk-Kwan LEE, Shoichi YAMAGUCHI, Mischa BONN, Akihiro MORITA, Tahei TAHARA
- Journal Title
  
  J.Am.Chem.Soc.
  
  Volume: 133 Issue: 42 Pages: 16875-16880
- DOI
  10.1021/ja2053754
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19056009, KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22750003
[Journal Article] Molecular Dynamics Simulation of Liquid Methanol. II. Unified Assignment of Infrared, Raman, and Sum Frequency Generation Vibrational Spectra in Methyl C-H Stretching Region2011
- Author(s)
  T. Ishiyama, V. V. Sokolov, A. Morita
- Journal Title
  
  J. Chem. Phys
  
  Volume: 134 Issue: 2
- DOI
  10.1063/1.3514146
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Molecular Dynamics Simulation of Liquid Methanol. I. Molecular Modeling including C-H Vibration and Fermi Resonance2011
- Author(s)
  T. Ishiyama, V. V. Sokolov, A. Morita
- Journal Title
  
  J. Chem. Phys
  
  Volume: 134 Issue: 2
- DOI
  10.1063/1.3514139
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Unified Molecular View of Air/Water Interface Based on Experimental and Theoretical X^<(2)> Spectra of Isotopically Diluted Water Surface2011
- Author(s)
  Satoshi Nihonyanagi, Tatsuya Ishiyama, Touk-kwan Lee, Shoichi Yamaguchi, Mischa Bonn, Akihiro Morita, Tahei Tahara
- Journal Title
  
  J.Am.Chem.Soc.
  
  Volume: 133/42 Pages: 16875-16880
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Molecular Dynamics Simulation of Sum Frequency Generation Spectra of Aqueous Sulfuric Acid Solution2011
- Author(s)
  T. Ishiyama, A. Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 115 Issue: 28 Pages: 13704-13716
- DOI
  10.1021/jp200269k
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22750003
[Journal Article] Electric Quadrupole Contribution to the Nonresonant Background of Sum Frequency Generation at Air/Liquid Interfaces2011
- Author(s)
  Shoichi Yamaguchi, Kazuya Shiratori, Akihiro Morita, Tahei Tahara
- Journal Title
  
  J.Chem.Phys.
  
  Volume: 134 Pages: 184705-184711
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Electric quadrupole contribution to the nonresonant background of sum frequency generation at air/liquid interfaces2011
- Author(s)
  S. YAMAGUCHI, K. SHIRATORI, A. MORITA, T. TAHARA
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 134 Pages: 184705-184705
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19056009
[Journal Article] Electric quadrupole contribution to the nonresonant background of sum frequency generation at air/liquid interfaces2011
- Author(s)
  Shoichi YAMAGUCHI, Kazuya SHIRATORI, Akihiro MORITA, Tahei TAHARA
- Journal Title
  
  J.Chem.Phys.
  
  Volume: 134 Issue: 18 Pages: 184705-184705
- DOI
  10.1063/1.3586811
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19056009, KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-22350014
[Journal Article] Vibrational Spectrum at Water Surface : A Hybrid Quantum Mechanics/Molecular Mechanics Molecular Dynamics Approach2011
- Author(s)
  Tatsuya Ishiyama, Hideaki Takahashi, Akihiro Morita
- Journal Title
  
  J.Phys. : Condens.Matter
  
  Volume: 24 Pages: 124107-124113
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Nonlinear Vibrational Spectroscopic Studies on Water/Ionic Liquid([Cnmim]TFSA : n=4,8) Interfaces2011
- Author(s)
  T.Iwahashi
- Journal Title
  
  Faraday Discussions
  
  Volume: 154 Pages: 289-301
- DOI
  10.1039/c1fd00061f
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19105005, KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-23350005, KAKENHI-PROJECT-22750003
[Journal Article] Molecular Theory on Dielectric Constant at Interfaces : A Molecular Dynamics Study of the Water/Vapor Interface2011
- Author(s)
  Kazuya Shiratori, Akihiro Morita
- Journal Title
  
  J.Chem.Phys.
  
  Volume: 134 Pages: 234705-234714
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Molecular Theory on Dielectric Constant at Interfaces : A Molecular Dynamics Study of the Water/Vapor Interface2011
- Author(s)
  K. Shiratori, A. Morita
- Journal Title
  
  J. Chem. Phys
  
  Volume: 134 Issue: 23
- DOI
  10.1063/1.3598484
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Surface Structure of Sulfuric Acid Solution Relevant to Sulfate Aerosol : Molecular Dynamics Simulation Combined with Sum Frequency Generation Measurement2011
- Author(s)
  T. Ishiyama, A. Morita, T. Miyamae
- Journal Title
  
  Phys. Chem. Chem. Phys
  
  Volume: 13 Issue: 47 Pages: 20965-20973
- DOI
  10.1039/c1cp21920k
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002, KAKENHI-PROJECT-23550213, KAKENHI-PROJECT-22750003
[Journal Article] Surface Structure of Sulfuric Acid Solution Relevant to Sulfate Aerosol : Molecular Dynamics Simulation Combined with Sum Frequency Generation Measurement2011
- Author(s)
  Tatsuya Ishiyama, Akihiro Morita, Takayuki Miyamae
- Journal Title
  
  Phys.Chem.Chem.Phys.
  
  Volume: 13 Pages: 20965-20973
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Half hydration” at the air/water interface revealed by HD-ESFG spectroscopy, polarization SHG, and MD simulation2010
- Author(s)
  H. WATANABE, S. YAMAGUCHI, S. SEN, A. MORITA, T. TAHARA
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 132
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19056009
[Journal Article] 'Half hydration' at the air/water interface revealed by HD-ESFG spectroscopy, polarization SHG, and MD simulation2010
- Author(s)
  渡邊秀和、山口祥一、Sen Sobhan、森田明弘、田原太平
- Journal Title
  
  J.Chem.Phys 132
  
  Pages: 144701-144709
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20050003
[Journal Article] Half-hydration" at the air/water interface revealed by heterodyne-detected electronic sum frequency generation spectroscopy, polarization second harmonic generation, and molecular dynamics simulation2010
- Author(s)
  Hidekazu Watamabe, Shoichi Yamaguchi, Sobhan Sen, Akihiko Morita, Tahei Tahara
- Journal Title
  
  J.Chem.Phys.
  
  Volume: 132
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19056009
[Journal Article] 'Half hydration' at the air/water interface revealed by HD-ESFG spect roscopy, polarization SHG, and MD simulation2010
- Author(s)
  渡邊秀和、山口祥一、Sen Sobhan、森田明弘、田原太平
- Journal Title
  
  J.Chem.Phys (発行予定)
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] 'Half hydration' at the air/water interface revealed by HD-ESFG spectroscopy, polarization SHG, and MD simulation2010
- Author(s)
  渡邊秀和、山口祥一、Sen Sobhan、森田明弘、田原太平
- Journal Title
  
  J.Chem.Phys 132
  
  Pages: 144701-144709
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20038003
[Journal Article] 'Half Hydration' at the Air/Water Interface Revealed by HD-ESFG Spectroscopy, Polarization SHG, and MD Simulation2010
- Author(s)
  H. Watanabe, S. Yamaguchi, S. Sen, A. Morita, T. Tahara
- Journal Title
  
  J. Chem. Phys
  
  Volume: 132 Issue: 14
- DOI
  10.1063/1.3372620
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Vibrational Spectroscopic Response of Intermolecular Orientational Correlation at the Water Surface2009
- Author(s)
  T. Ishiyama, A. Morita
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 113 Issue: 37 Pages: 16299-16302
- DOI
  10.1021/jp9060957
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Analysis of Anisotropic Local Field in Sum Frequency Generation Spectroscopy with the Charge Response Kernel Water Model2009
- Author(s)
  森田明弘、石山達也
- Journal Title
  
  J.Chem.Phys 131
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20050003
[Journal Article] 水の界面でイオンの織りなす構造---大気化学からホフマイスター系列まで2009
- Author(s)
  森田明弘
- Journal Title
  
  化学 6412月号
  
  Pages: 68-69
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Analysis of Anisotropic Local Field in Sum Frequency Generation Spectroscopy with the Charge Response Kernel Water Model2009
- Author(s)
  T. Ishiyama, A. Morita
- Journal Title
  
  J. Chem. Phys
  
  Volume: 131 Issue: 24
- DOI
  10.1063/1.3279126
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Analysis of Anisotropic Local Field in Sum Frequency Generation Spectroscopy with the Charge Response Kernel Water Model2009
- Author(s)
  森田明弘、石山達也
- Journal Title
  
  J.Chem.Phys 131
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20038003
[Journal Article] 水の界面でイオンの織りなす構造---大気化学からホフマイスター系列まで2009
- Author(s)
  森田明弘
- Journal Title
  
  化学 6412月号
  
  Pages: 68-69
- Data Source
  KAKENHI-PROJECT-20050003
[Journal Article] 水の界面でイオンの織りなす構造 --- 大気化学からホフマイスター系列まで2009
- Author(s)
  森田明弘
- Journal Title
  
  化学
  
  Volume: 64(12月号) Pages: 68-69
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Vibrational Spectroscopic Response of Intermolecular Orientational Correlation at the Water Surface2009
- Author(s)
  森田明弘、石山達也
- Journal Title
  
  J.Phys.Chem.C 131
  
  Pages: 16299-16302
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Analysis of Anisotropic Local Field in Sum Frequency Generation Spectroscopy with the Charge Response Kernel Water Model2009
- Author(s)
  森田明弘、石山達也
- Journal Title
  
  J.Chem.Phys 131
  
  Pages: 244714-17
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21245002
[Journal Article] Vibrational Spectroscopic Response of Intermolecular Orientational Correlation at the Water Surface2009
- Author(s)
  森田明弘、石山達也
- Journal Title
  
  J.Phys.Chem.C 131
  
  Pages: 16299-16302
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20050003
[Journal Article] 水の界面でイオンの織りなす構造…大気化学からホフマイスター系列まで2009
- Author(s)
  森田明弘
- Journal Title
  
  化学 64 12月号
  
  Pages: 68-69
- Data Source
  KAKENHI-PROJECT-20038003
[Journal Article] Vibrational Spectroscopic Response of Intermolecular Orientational Correlation at the Water Surface2009
- Author(s)
  森田明弘、石山達也
- Journal Title
  
  J.Phys.Chem.C 131
  
  Pages: 16299-16302
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20038003
[Journal Article] First Acid Dissociation at Aqueous H2504 Interface with Sum Frequency Generation Spectroscopy2008
- Author(s)
  T. Miyamae, A. Morita, Y. Ouchi
- Journal Title
  
  Phys. Chem. Chem. Phys 10
  
  Pages: 2010-2013
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20050003
[Journal Article] Molecular Theory of Mass Transfer Kinetics and Dynamics at Gas/Water Interface2008
- Author(s)
  A. Morita, B.C. Garrett
- Journal Title
  
  Flu. Dyn. Res 40
  
  Pages: 459-473
- NAID
  10021168426
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20038003
[Journal Article] Recent Progress in Theoretical Analysis of Vibrational Sum Frequency Generation Spectroscopy2008
- Author(s)
  A.Morita, T. Ishiyama
- Journal Title
  
  Phys. Chem. Chem. Phys 10
  
  Pages: 5801-5816
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20050003
[Journal Article] Recent Progress in Theoretical Analysis of Vibrational Sum Frequency Generation Spectroscopy2008
- Author(s)
  A. Morita, T. Ishiyama
- Journal Title
  
  Phys. Chem. Chem. Phys 10
  
  Pages: 5801-5816
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20038003
[Journal Article] First Acid Dissociation at an Aqueous H_2SO_4 Interface with Sum Frequency Generation Spectroscopy2008
- Author(s)
  T.Miyamae, A. Morita, Y. Ouchi
- Journal Title
  
  Physical Chemistry Chemical Physics 10
  
  Pages: 2010-2013
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19029043
[Journal Article] Molecular Theory of Mass Transfer Kinetics and Dynamics at Gas / Water Interface2008
- Author(s)
  A. Morita, B. C. Garrett
- Journal Title
  
  Flu. Dyn. Res 40
  
  Pages: 459-473
- NAID
  10021168426
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20050003
[Journal Article] First Acid Dissociation at an Aqueous H2SO4 with Sum-Frequency Generation Spectroscopy2008
- Author(s)
  T. Miyamae, A. Morita, and Y. Ouchi
- Journal Title
  
  Phys Chem. Chem, Phys 10
  
  Pages: 2010-2013
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18550025
[Journal Article] First Acid Dissociation at Aqueous H2SO4 Interface with Sum Frequency Generation Spectroscopy2008
- Author(s)
  T. Miyamae, A. Morita, Y. Ouchi
- Journal Title
  
  Phys. Chem. Chem. Phys 10
  
  Pages: 2010-2013
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20038003
[Journal Article] Molecular Dynamics Analysis of Interfacial Structures and Sum Frequency Generation Spectra of Aqueous Hydrogen Halide Solutions2007
- Author(s)
  T. Ishiyama, A. Morita
- Journal Title
  
  J. Phys. Chem. A 111
  
  Pages: 9277-9285
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19029043
[Journal Article] Improved Computation of sum Frequency Generation Spectrum of Water Surface2006
- Author(s)
  Akihiro Morita
- Journal Title
  
  J. Phys. Chem.B 110/7
  
  Pages: 3158-3163
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Molecular Simulation of the Transport of Molecules across the Liquid/Vapor Interface of Water2006
- Author(s)
  Bruce C.Garrett, Gregory K.Schenter, Akihiro Morita
- Journal Title
  
  Chem.Rev. 106/4
  
  Pages: 1355-1374
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Molecular Simulation of the TransportofMolecules across the Liquid/Vapor Interface of Water2006
- Author(s)
  Bruce C.Garrett, Gregory K.Schenter, Akihiro Morita
- Journal Title
  
  Chem. Rev. 106/4
  
  Pages: 1355-1374
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Molecular Simulation of the Transport of Molecules across the Liquid/Vapor Interface of Water2006
- Author(s)
  Bruce C.Garrett, Gregory K.Schenter, Akihiro Morita
- Journal Title
  
  Chem.Rev. (in press)
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Improved Computation of Sum Frequency Generation Spectrum of Water Surface2006
- Author(s)
  Akihiro Morita
- Journal Title
  
  J.Phys.Chem.B 110/7
  
  Pages: 3158-3163
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Charge Response Kernel Theory based on Ab Initio and Density Functional Calculations2005
- Author(s)
  Akihiro Morita, Tateki Ishida
- Journal Title
  
  Lecture Series on Computer and Computatinal Sciences 4
  
  Pages: 663-666
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Electronic relaxation dynamics of Ni^<2+> ion aqueous solution : Molecular dynamics simulation2005
- Author(s)
  Satoru Iuchi, Akihiro Morita, Shigeki Kato
- Journal Title
  
  J.Chem.Phys. 123
  
  Pages: 24505-24505
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Reply to Comment on Mass Accommodation Coefficient of Water : Molecular Dynamics Simulation and Revised Analysis of Droplet Train/Flow Reactor Experiment2005
- Author(s)
  Akihiro Morita, Masakazu Sugiyama, Seiichiro Koda, David R.Hanson
- Journal Title
  
  J.Phys.Chem.B 109/30
  
  Pages: 14747-14749
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Charge Response Kernel Theory based on Ab Initio and Density Functional Calculations2005
- Author(s)
  Akihiro Morita, Tateki Ishida
- Journal Title
  
  Lecture Series on Computer and Computational Sciences 4
  
  Pages: 663-666
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Charge Response Kernel Theory based on Ab Initio and Density Functional Calculations2005
- Author(s)
  Akihiro Morita, Takeki Ishida
- Journal Title
  
  Lecture Series on Computer and Computational Sciences 4
  
  Pages: 663-666
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Electronic relaxation dynamics of Ni_2^+-ion aqueous solution : Molecular-dynamics simulation.2005
- Author(s)
  S.Iuchi, A.Morita, S.Kato
- Journal Title
  
  J.Chem.Phys. 123
- Data Source
  KAKENHI-PROJECT-14GS0217
[Journal Article] Electronic relaxation dynamics of NiZ + ion aqueous solution : Moleeular dynamics simulation2005
- Author(s)
  Satoru Iuchi, AkihiroMorita, Shigeki Kato
- Journal Title
  
  J. Chem. Phys. 123
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Reply toComment on 'Mass Accommodation Coefficient of Water : Molecular Dynamicsics Simulation and Revised Analysis of Droplet Train/Flow Reactor Experiment'2005
- Author(s)
  Akihiro Morita, Masakazu Sugiyama, Seiichiro Koda, David R. Hanson
- Journal Title
  
  J. Phys. Chem.B 109/30
  
  Pages: 14747-14749
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Reply to "Comment on 'Mass Accommodation Coefficient of Water : Molecular Dynamics Simulation and Revised Analysis of Droplet Train/Flow Reactor Experiment'"2005
- Author(s)
  Akihiro Morita, Masakazu Sugiyama, Seiichiro Koda, David R.Hanson
- Journal Title
  
  J.Phys.Chem.B 109/30
  
  Pages: 14747-14749
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Mass Accommodation Coefficient of Water : Molecular Dynamics Simulation and Revised Analysis of Droplet Train/Flow Reactor Experiment2004
- Author(s)
  A.Morita, M.Sugiyama, H.Kameda, S.Koda, D.R.Hanson
- Journal Title
  
  J.Phys.Chem.B 108/26
  
  Pages: 9111-9120
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Uptakeof the H0_2 Radical by Water : Molecular Dynamics CalculationsandTheir Implications to Atmospheric Modeling2004
- Author(s)
  Akihiro Morita, Yugo Kanaya, Joseph S. Francisco
- Journal Title
  
  J. Geophys. Res. 109/D9
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Mass Accommodation Coefficient of Water : Molecular Dynamics Simulation and Revised Analysis of Droplet Train/Flow Reactor Experiment2004
- Author(s)
  Akihiro Morita, Masakazu Sugiyama Hirofumi Kameda, Seiichiro Koda, David R.Hanson
- Journal Title
  
  J.Phys.Chem. B 108/26
  
  Pages: 9111-9120
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Potential Energy Surfaces and Dynamics of Ni^2^+ Ion Aqueous Solution : Molecular Dynamics Simulation of the Electronoc Absorption Spectrum2004
- Author(s)
  Satoru Iuchi, Akihiro Morita, Shigeki Kato
- Journal Title
  
  J. Chem. Phys 121/17
  
  Pages: 8446-8457
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Toward Computation of Bulk QuadruPolar Signals in Vibrational Sum Frequency Generation Spectroscopy2004
- Author(s)
  Akihiro Morita
- Journal Title
  
  Chem. Phys. Lett. 398/4・6
  
  Pages: 361-366
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Reply to Comment on 'Gas-Phase Flow and Diffusion Analysis of the Droplet Train/Flow Reactor Technique for the Mass Accommodation Processes'2004
- Author(s)
  A.Morita, M.Sugiyama, S.Koda
- Journal Title
  
  J.Phys.Chem.A 108/40
  
  Pages: 8544-8545
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Potential energy surfaces and dynamics of Ni2+ ion aqueous solution : Molecular dynamics simulation of the electronic absorption spectrum2004
- Author(s)
  S.Iuchi, A.Morita, S.Kato
- Journal Title
  
  J.Chem.Phys. 121
  
  Pages: 8446-8457
- Data Source
  KAKENHI-PROJECT-14GS0217
[Journal Article] Potential Energy Surfaces and Dynamics of Ni^<2+> Ion Aqueous Solution : Molecular Dynamics Simulation of the Electronic Absorption Spectrum2004
- Author(s)
  Satoru Iuchi, Akihiro Morita, Shigeki Kato
- Journal Title
  
  J.Chem.Phys. 121/17
  
  Pages: 8446-8457
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Uptake of the HO_2 Radical by Water : Molecular Dynamics Calculations and Their Implications to Atmospheric Modeling2004
- Author(s)
  Akihiro Morita, Yugo Kanaya, Joseph S.Francisco
- Journal Title
  
  J.Geophys.Res. 109/D9
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Revised Kinetics in the Droplet Train Apparatus Due to a Wall Loss2004
- Author(s)
  David R.Hanson, Masakazu Sugiyama, Akihiro Morita
- Journal Title
  
  J.Phys.Chem. A 108/17
  
  Pages: 3739-3744
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Reply toIComment on 'Gas-Phase Flow and Diffusion Analysis of the Droplet Train/Flow Reactor Technique for the Mass Accommodation Process'2004
- Author(s)
  Akihiro Morita, Masakazu Sugiyama, Seiichiro Koda
- Journal Title
  
  J.Phys. Chem. A 108/40
  
  Pages: 8544-8545
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Potential Energy Surfaces and Dynamics of Ni^<2+> Jon Aqueous Solution : Molecular Dynamics Simulation of the Electronic Absorption Spectrum2004
- Author(s)
  Satoru Iuchi, Akihiro Morita, Shigeki Kato
- Journal Title
  
  J.Chem.Phys. 121/17
  
  Pages: 8446-8457
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Mass Accommodation Coefficient ofwater : Molecular Dynamics Simulation and Revised Analysisof Droplet Train/Flow Reactor Experiment2004
- Author(s)
  Akihiro Morita, Masakazu Sugiyama, Hirofumi Kameda, Seiichiro Koda, David R. Hanson
- Journal Title
  
  J.Phys. Chem. B 108/26
  
  Pages: 9111-9120
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Toward Computation of Bulk Quadrupolar Signals in Vibrational Sum Frequency Generation Sepctroscopy2004
- Author(s)
  Akihiro Morita
- Journal Title
  
  Chem.Phys.Lett. 398/4-6
  
  Pages: 361-366
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Reply to "Comment on 'Gas-Phase Flow and Diffusion Analysis of the Droplet Train/Flow Reactor Technique for the Mass Accommodation Processes'"2004
- Author(s)
  Akihiro Morita, Masakazu Sugiyama, Seiichiro Koda
- Journal Title
  
  J.Phys.Chem. A 108/40
  
  Pages: 8544-8545
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Uptake of the HO_2 Radical by Water : Molecular Dynamics Calculations and Their Implications to Atmospheric Modeling2004
- Author(s)
  A.Morita, Y.Kanaya, J.S.Francisco
- Journal Title
  
  J.Geophys.Res. 109/D9D09201doi:10.1029/2003JD004240
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Toward Computation of Bulk Quadrupolar Signals in Vibrational Sum Frequency Generation Spectroscopy2004
- Author(s)
  Akihiro Morita
- Journal Title
  
  Chem.Phys.Lett. 398/4-6
  
  Pages: 361-366
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Revised Kinetics in the Droplet Train Apparatus Due to a Wall Loss2004
- Author(s)
  D.R.Hanson, S.Sugiyama, A.Morita
- Journal Title
  
  J.Phys.Chem.A 108/17
  
  Pages: 3739-3744
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Revised Kinetics in the Droplet TrainApparatus Due to AWall Loss2004
- Author(s)
  David R.Hanson, Masakazu Sugiyama, Akihiro Morita
- Journal Title
  
  J. Phys. Chem.A 108/17
  
  Pages: 3739-3744
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Templating Effects on Mineralization of Layered Inorganic Compounds : (1)Density Functional Calculations of Formation of Single Layered Magnesium Hydroxide as a Brucite Model2003
- Author(s)
  Hisako Sato, Akihiro Morita, Kanta Ono, Haruyuki Nakano, Noboru Wakabayashi, Akihiko Yamagishi
- Journal Title
  
  Langmuir 19/17
  
  Pages: 7120-7126
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Templating Effects on Mineralization of Layered Inorganic Compounds : (1) Density Functional calculations of Formation of Single Latered Magnesium Hydroxide as a Brucite Model2003
- Author(s)
  Hisako Sato, Akihiro Morita, Kanta Ono, haruyuki Nakano, Noboru Wakabayashi, Akihiko Yamagishi
- Journal Title
  
  Langmuir 19/17
  
  Pages: 7120-7126
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Molecular Dynamics Study of Mass Accommodation of Methanol at Liquid-Vapor Intergace of Methanol/Water Binary Solutions od Various Concentrations,2003
- Author(s)
  Akihiro Morita
- Journal Title
  
  Chem, Phys. Lett 375
  
  Pages: 1-8
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Molecular Dynamics Study of Mass Accommodation of Methanol at Liquid-Vapor Interface of Methanol/Water Binary Solutions of Various Concentrations2003
- Author(s)
  Akihiro Morita
- Journal Title
  
  Chem.Phys.Lett. 375
  
  Pages: 1-8
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Templating Effects on Mineralization of Layered Inorganic Compounds:(1)Density Functional Calculations of Formation of Single Layered Magnesium Hydroxide as a Brucite Model2003
- Author(s)
  Hisako Sato, Akihiro Morita, Kanta Ono, Haruyuki Nakano, Noboru Wakabayashi, Akihiko Yamagishi
- Journal Title
  
  Langmuir 19/17
  
  Pages: 7120-7126
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550012
[Journal Article] Half hydration" at the air/water interface revealed by HD-ESFG spectroscopy, polarization SHG, and MD simulation
- Author(s)
  Hidekazu WATANABE, Shoichi YAMAGUCHI, Sobhan SEN, Akihiko MORITA, Tahei TAHARA
- Journal Title
  
  J.Chem.Phys. (in press)
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19056009
[Presentation] 和周波発生分光における磁気双極子成分の評価2023
- Author(s)
  熊谷紘一、平野智倫、森田明弘
- Organizer
  第17回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 和周波スペクトル計算にバルクの境界と四重極が与える影響2023
- Author(s)
  平野智倫、森田明弘
- Organizer
  第25回理論化学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 液々界面での多価イオンの輸送の多次元自由エネルギー計算と反応機構解析2023
- Author(s)
  仲海渡、平野智倫、森田明弘
- Organizer
  第17回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Evaluation of magnetic dipole components in sum frequency generation spectroscopy2023
- Author(s)
  熊谷紘一、平野智倫、森田明弘
- Organizer
  第9回SFG研究会
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Electron Transfer Mechanism at Liquid/Liquid Interfaces Revealed by Multi-Dimensional Free Energy Analyses2023
- Author(s)
  T. Hirano and A. Morita
- Organizer
  International Symposium for the 80th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 水表面での特異的に高速なフェノール光化学反応機構の解明2023
- Author(s)
  石山達也、田原太平、森田明弘
- Organizer
  第17回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Issues on Boundary and Quadrupole in Calculations of Sum-Frequency Generation Spectra2023
- Author(s)
  平野智倫、森田明弘
- Organizer
  第9回SFG研究会
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Boundary Effects in SFG Calculations and Quadrupole Contribution2023
- Author(s)
  A. Morita
- Organizer
  2023 International Conference on Nonlinear Optics at Interfaces
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 和周波スペクトル計算におけるバルクの境界と四重極の影響2023
- Author(s)
  平野智倫、森田明弘
- Organizer
  第17回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 液液界面における界面誘電率のMDシミュレーション2023
- Author(s)
  安達友揮、平野智倫、森田明弘
- Organizer
  第25回理論化学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Molecular dynamics analysis of structural fluctuation, complexation, and electron transfer reaction at immiscible liquid interfaces2023
- Author(s)
  A. Morita
- Organizer
  9th Asian Conference on Colloid and Interface Science
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 分子シミュレーションによる界面誘電率の計算と界面張力との関係2023
- Author(s)
  安達友揮、平野智倫、森田明弘
- Organizer
  第17回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Fresnel Dispersion in Sum Frequency Generation Spectroscopy2023
- Author(s)
  森田明弘
- Organizer
  第9回SFG研究会
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 水油界面でのイオン輸送効率に対する微量な水の効果の解明2023
- Author(s)
  上村哲平、平野智倫、森田明弘
- Organizer
  第17回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Multidimensional free energy analysis of electron and ion transfer reactions through immiscible liquid interfaces2023
- Author(s)
  A. Morita
- Organizer
  6th International Conference on Molecular Simulation (ICMS2023)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Theoretical Elucidation of On-Water Photochemical Reaction of Phenol2023
- Author(s)
  T. Ishiyama, T. Tahara, and A. Morita
- Organizer
  The 9th Quantum Science Symposium, ICCMSE 2023
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Transport and Reactions at Liquid Interfaces2023
- Author(s)
  A. Morita
- Organizer
  5th Conference of Theory and Applications of Computational Chemistry (TACC2023)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Computational Analysis of Sum Frequency Generation Spectroscopy for Exploring Interfaces2023
- Author(s)
  A. Morita
- Organizer
  GP-Chem Kickoff Symposium
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Microscopic Mechanisms of Ion Transport and Reactions at Liquid-Liquid Interface2023
- Author(s)
  A. Morita
- Organizer
  Kavli Exploration Conference "Interfaces and Mixing in Fluids, Plasmas, Materials"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 分子シミュレーションと理論化学2022
- Author(s)
  森田明弘
- Organizer
  第16回分子シミュレーションスクール
- Invited
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 溶液界面の構造解明を目的とした新規グランドカノニカル分子動力学法の開発2022
- Author(s)
  今泉伊織、平野智倫、森田明弘
- Organizer
  第24回理論化学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Development of Computational Analysis of Difference Vibrational Spectroscopy2022
- Author(s)
  A. Morita
- Organizer
  ICCMSE 2022
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 疎水性及び親水性水和殻構造における水の振動スペクトルの理論解析2022
- Author(s)
  丸岡俊政、平野智倫、矢澤尚也、森田明弘
- Organizer
  第16回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 分子シミュレーションと理論化学2022
- Author(s)
  森田　明弘
- Organizer
  第16回分子シミュレーションスクール - 基礎から応用まで -
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 構造ゆらぎがある気液界面の熱抵抗の分子シミュレーション2022
- Author(s)
  伊藤大晟、小川陽菜乃、伊藤孟、森田明弘
- Organizer
  第16回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 液液界面の構造ゆらぎとその機能の分子科学2022
- Author(s)
  森田　明弘
- Organizer
  第35期ＣＡＭＭフォーラム
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 様々な振動差スペクトルに適用可能な効率的計算手法2022
- Author(s)
  平野智倫、矢澤尚也、王琳、森田明弘
- Organizer
  第16回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Development of Computational Analysis of Difference Vibrational Spectroscopy2022
- Author(s)
  A. Morita
- Organizer
  The 8th Quantum Science Symposium, ICCMSE 2022
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Theory of Surface Nonlinear Spectroscopy2022
- Author(s)
  A. Morita
- Organizer
  Global Initiatives of Academic Network
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 振動差スペクトル計算の劇的な収束加速2022
- Author(s)
  平野智倫、矢澤尚也、王琳、森田明弘
- Organizer
  第24回理論化学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 新規グランドカノニカル分子動力学法による電解質水溶液界面の構造解明2022
- Author(s)
  今泉伊織、平野智倫、森田明弘
- Organizer
  第16回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Theory of Surface Nonlinear Spectroscopy2022
- Author(s)
  A. Morita
- Organizer
  Global Initiatives of Academic Network (GIAN)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] ecent Theoretical Studies of SFG Spectroscopy and Water Surface2022
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on "Nonlinear Optics at Interfaces"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Recent Theoretical Studies of SFG Spectroscopy and Water Surface2022
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液液界面の構造ゆらぎとその機能の分子科学2022
- Author(s)
  森田明弘
- Organizer
  第３５期ＣＡＭＭフォーラム
- Invited
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 水表面におけるフェノール光化学の超高速反応機構の解明2022
- Author(s)
  石山達也、田原太平、森田明弘
- Organizer
  第24回理論化学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] New Perspectives on Chemical Reactions and Transport at Liquid-Liquid Interfaces2021
- Author(s)
  A. Morita
- Organizer
  Pacifichem 2021, Symposium "Exploring Complex and Real Systems using Large-Scale Molecular Dynamics Calculations"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 油水界面を反応場とする相間移動触媒反応の反応機構解析2021
- Author(s)
  小泉愛、岸本直樹、高橋英明、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 電子共鳴を含むSFG計算の開発とキラル系への応用2021
- Author(s)
  細谷毅、王琳、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 電子共鳴を含むSFG計算の開発とキラル系への応用2021
- Author(s)
  細谷毅、王琳、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Theoretical investigation of sum frequency generation spectroscopy on carbon-based electrode-electrolyte interfaces2021
- Author(s)
  L. Wang, A. Morita
- Organizer
  Pacifichem 2021, Symposium "Advanced Understanding of Soft Interfaces at the Molecular-Scale"
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Ozone oxidation of the unsaturated phospholipid monolayer in ambient air revealed by HD-SFG spectroscopy2021
- Author(s)
  K. Inoue、C. Takada、L. Wang、 A. Morita、 and S. Ye
- Organizer
  Pacifichem 2021, Symposium "Advanced Understanding of Soft Interfaces at the Molecular-Scale
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Ozone oxidation of the unsaturated phospholipid monolayer in ambient air revealed by HD-SFG spectroscopy2021
- Author(s)
  K. Inoue, C. Takada, L. Wang, A. Morita, S. Ye
- Organizer
  Pacifichem 2021, Symposium "Advanced Understanding of Soft Interfaces at the Molecular-Scale"
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 和周波発生分光における四重極成分の時間依存形式による計算2021
- Author(s)
  平野智倫、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Microscopic Dielectric Constant and Sum Frequency Generation Spectroscopy of Monolayer Interfaces Evaluated by Molecular Dynamics Simulation2021
- Author(s)
  L. Wang、and A. Morita
- Organizer
  MRM2021
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 疎水性水和殻構造における水の振動スペクトルの理論解析2021
- Author(s)
  丸岡俊政、平野智倫、矢澤尚也、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液液界面のイオン通過での触媒の効果と特異性の分子機構2021
- Author(s)
  小泉愛、田原寛文、平野智倫、森田明弘
- Organizer
  第35回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] New Perspectives on Chemical Reactions and Transport at Liquid-Liquid Interfaces2021
- Author(s)
  A. Morita
- Organizer
  Pacifichem 2021, Symposium "Exploring Complex and Real Systems using Large-Scale Molecular Dynamics Calculations"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Multidimensional free energy analysis on electron transfer mechanism at the oil/water interface2021
- Author(s)
  T. Hirano、and A. Morita
- Organizer
  Pacifichem 2021, Symposium "Advanced Understanding of Soft Interfaces at the Molecular-Scale
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液界面のイオン通過での触媒の効果と特異性の分子機構2021
- Author(s)
  小泉愛、田原寛文、平野智倫、森田明弘
- Organizer
  第35回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 振動差スペクトル計算の並列実装による効率化と水/電極表面への応用2021
- Author(s)
  矢澤尚也、平野智倫、、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 極端紫外レーザー光電子分光による気液界面の電子状態の研究2021
- Author(s)
  山本遥一、石山達也、森田明弘、鈴木俊法
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 溶液系界面を対象とするグランドカノニカル分子動力学法の開発2021
- Author(s)
  今泉伊織、平野智倫、内藤暢也、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 極端紫外レーザー光電子分光による気液界面の電子状態の研究2021
- Author(s)
  山本遥一、石山達也、森田明弘、鈴木俊法
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 多次元自由エネルギー計算による液液界面における電子移動反応機構の解明2021
- Author(s)
  平野智倫、森田明弘
- Organizer
  第23回理論化学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 振動差スペクトル計算の並列実装による効率化と水/電極表面への応用2021
- Author(s)
  矢澤尚也、平野智倫、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 分子シミュレーションと理論化学2021
- Author(s)
  森田　明弘
- Organizer
  第15回分子シミュレーションスクール　基礎から応用まで　2021
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Quantitative determination of Fresnel factor dispersion in the analysis of sum-frequency generation spectroscopy2021
- Author(s)
  王琳、村田凌、井上賢一、叶深、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Microscopic Mechanisms of Facilitated Ion Transfer and Electron Transfer Reaction at Liquid-Liquid Interface2021
- Author(s)
  A. Morita, A. Koizumi, and T. Hirano
- Organizer
  The 7th Quantum Science Symposium, ICCMSE 2021 - Computational Chemistry and Computational Physics
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 有機溶媒界面のイオン輸送反応における微量の水の触媒効果2021
- Author(s)
  市川怜奈、小泉愛、平野智倫、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Quantitative determination of Fresnel factor dispersion in the analysis of sum-frequency generation spectroscopy2021
- Author(s)
  王琳、村田凌、井上賢一、叶深、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 疎水性水和殻構造における水の振動スペクトルの理論解析2021
- Author(s)
  丸岡俊政、平野智倫、、矢澤尚也、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 極端紫外レーザー光電子分光による気液界面の電子状態の研究2021
- Author(s)
  山本遥一、石山達也、森田明弘、鈴木俊法
- Organizer
  原子衝突学会第46回年会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Microscopic Dielectric Constant and Sum Frequency Generation Spectroscopy of Monolayer Interfaces Evaluated by Molecular Dynamics Simulation2021
- Author(s)
  L. Wang, A. Morita
- Organizer
  MRM2021
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 和周波発生分光における四重極成分の時間依存形式による計算2021
- Author(s)
  平野智倫、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Development and Application of Quadrupole Susceptibility Analyzer in SFG Spectroscopy2021
- Author(s)
  A. Morita
- Organizer
  Pacifichem 2021, Symposium "Advanced Understanding of Soft Interfaces at the Molecular-Scale
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Development and Application of Quadrupole Susceptibility Analyzer in SFG Spectroscopy2021
- Author(s)
  A. Morita
- Organizer
  Pacifichem 2021, Symposium "Advanced Understanding of Soft Interfaces at the Molecular-Scale"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Zundel-Eigen transformation of hydrated proton at the air-water interface revealed by HD-VSFG spectroscopy and MD simulation2021
- Author(s)
  Ahmed Mohammed, Tatsuya Ishyama，Ken-ichi Inoue，Satoshi Nihonyanagi，Akihiro Morita，Tahei Tahara
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Theoretical investigation of sum frequency generation spectroscopy on carbon-based electrode-electrolyte interfaces2021
- Author(s)
  L. Wang、and A. Morita
- Organizer
  Pacifichem 2021, Symposium "Advanced Understanding of Soft Interfaces at the Molecular-Scale"
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 溶液系界面を対象とするグランドカノニカル分子動力学法の開発2021
- Author(s)
  今泉伊織、平野智倫、内藤暢也、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Multidimensional free energy analysis on electron transfer mechanism at the oil/water interface2021
- Author(s)
  T. Hirano, A. Morita
- Organizer
  Pacifichem 2021, Symposium "Advanced Understanding of Soft Interfaces at the Molecular-Scale"
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Microscopic Mechanisms of Facilitated Ion Transfer and Electron Transfer Reaction at Liquid-Liquid Interface2021
- Author(s)
  A. Morita、A. Koizumi, and T. Hirano
- Organizer
  The 7th Quantum Science Symposium、 ICCMSE 2021 -- Computational Chemistry and Computational Physics
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 極端紫外レーザー光電子分光による気液界面の電子状態の研究2021
- Author(s)
  山本遥一、石山達也、森田明弘、鈴木俊法
- Organizer
  原子衝突学会第46回年会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 油水界面を反応場とする相間移動触媒反応の反応機構解析2021
- Author(s)
  小泉愛、岸本直樹、高橋英明、森田明弘
- Organizer
  第15回分子科学討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] Development of Qsac Program to Evaluate Whole SFG Susceptibility2020
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on "Nonlinear Optics at Interfaces"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Development of Qsac Program to Evaluate Whole SFG Susceptibility2020
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference on "Nonlinear Optics at Interfaces", Web online
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 電子共鳴によるキラルSFGのバルク・界面成分の理論解析2020
- Author(s)
  細谷毅、王琳、森田明弘
- Organizer
  分子科学会オンライン討論会
- Data Source
  KAKENHI-PROJECT-20H00368
[Presentation] 電子共鳴によるキラルSFGのバルク・界面成分の理論解析2020
- Author(s)
  細谷毅、王琳、森田明弘
- Organizer
  分子科学会オンライン討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 油水界面電子移動の多次元自由エネルギー計算による反応機構解析2019
- Author(s)
  平野智倫、森田明弘
- Organizer
  第33回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Development of grand canonical molecular dynamics method applied to solution interfaces2019
- Author(s)
  N. Naito, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2019
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 空気／陽・陰イオン性混合界面活性剤水溶液界面の水分子のHD-VSFG分光2019
- Author(s)
  佐々木伸一、奥野将成、石山達也、森田明弘、石橋孝章
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Mechanism of Ion Transport through Water-Oil Interface2019
- Author(s)
  森田明弘
- Organizer
  分子研研究会"Water at Interfaces
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 和周波発生分光におけるバルク四重極効果の汎用計算プログラムの開発2019
- Author(s)
  森渉、平野智倫、王琳、森田明弘
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Orientations of Water Molecules and Their Alkyl Chain Length Dependence at Air/Cationic Surfactant Solution Interfaces using HD-VSFG Spectroscopy2019
- Author(s)
  S. Sasaki, M. Okuno, T. Ishiyama, A. Morita, T. Ishibashi
- Organizer
  MANA International Symposium 2019
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Effect of frequency-dependent fresnel factor on the lineshape of vibrational sum frequency generation spectroscopy2019
- Author(s)
  L. Wang、S. Nihonyanagi、K. Inoue、K. Nishikawa、 A. Morita、S. Ye、T. Tahara
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Heterogeneity at Amorphous Silica/Water Interface: Molecular Dynamics Simulations of Sum Frequency Generation Spectroscopy2019
- Author(s)
  T. Joutsuka, A. Morita
- Organizer
  日本化学会第99春季年会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Heterogeneity at Amorphous Silica/Water Interface: Molecular Dynamics Simulations of Sum Frequency Generation Spectroscopy2019
- Author(s)
  T. Joutsuka and A. Morita
- Organizer
  日本化学会第99春季年会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによる油水界面電子移動の反応経路解析2019
- Author(s)
  平野智倫、森田明弘
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] HD-VSFG分光法による空気／陽・陰イオン性混合界面活性剤水溶液界面の水分子の配向の研究2019
- Author(s)
  佐々木伸一、奥野将成、石山達也、森田明弘、石橋孝章
- Organizer
  第4回TIA光・量子計測シンポジウム
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] ジクロロメタンの分子モデル改良とその分子動力学シミュレーションにおけるパフォーマンス2019
- Author(s)
  小泉愛、伊藤孟、平野智倫、森田明弘
- Organizer
  第33回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 溶液界面に適用されるグランドカノニカル分子動力学法の開発2019
- Author(s)
  内藤暢也、森田明弘
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Effect of frequency-dependent fresnel factor on the lineshape of vibrational sum frequency generation spectroscopy2019
- Author(s)
  L. Wang, S. Nihonyanagi, K. Inoue, K. Nishikawa, A. Morita, S. Ye, T. Tahara
- Organizer
  International workshop on Nonlinear Optics at Interfaces 2019
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液体界面の構造と機能を解明する計算分子科学2019
- Author(s)
  森田明弘
- Organizer
  スーパーコンピューターワークショップ
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Dynamics and kinetics at liquid-liquid interfaces2019
- Author(s)
  A. Morita
- Organizer
  CPMD Meeting 2019
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Molecular dynamics simulation and sum frequency generation study on the structural order of langmuir monolayers2019
- Author(s)
  L. Wang、A. Morita
- Organizer
  The 5th International Conference on Molecular Simulation
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Orientations of Water Molecules and Their Alkyl Chain Length Dependence at Air/Catanionic Surfactant Solution Interfaces using HD-VSFG Spectroscopy2019
- Author(s)
  S. Sasaki, M. Okuno, T. Ishiyama, A. Morita, T. Ishibashi
- Organizer
  MANA International SYmposium 2019
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] ジメチルスルホキシド溶液/グラフェン電極界面における和周波発生分光と理論解析2019
- Author(s)
  佐藤大和、平野智倫、王琳、叶深、森田明弘
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 分子シミュレーションと理論化学2019
- Author(s)
  森田明弘
- Organizer
  第13回分子シミュレーションスクール -基礎から応用まで-
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Molecular dynamics analysis of catalytic effect on ion transport through liquid-liquid interface2019
- Author(s)
  A. Morita
- Organizer
  5th Computational Chemistry Symposium, ICCMSE2019
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Mechanism of Ion Transport through Water-Oil Interface2019
- Author(s)
  森田明弘
- Organizer
  分子研研究会 "Water at Interfaces 2018"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 和周波発生分光の理論と溶液界面の構造解明への応用2019
- Author(s)
  森田明弘
- Organizer
  日本化学会青森地区講演会
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Effect of fresnel dispersion in SFG spectroscopy2019
- Author(s)
  A. Morita
- Organizer
  The 2019 International Workshop on Nonlinear Optics at Interfaces
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Theory and computational analysis of vibrational sum frequency generation spectroscopy2019
- Author(s)
  A. Morita
- Organizer
  Changchun Institute of Applied Chemistry
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Theory and computational analysis of liquid interfaces and spectroscopy2019
- Author(s)
  A. Morita
- Organizer
  University of Cambridge
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液液界面のイオン輸送における標準速度定数の評価2019
- Author(s)
  伊藤孟、小泉愛、平野智倫、内藤暢也、森田明弘
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Theory and computational analysis of vibrational sum frequency generation spectroscopy2019
- Author(s)
  A. Morita
- Organizer
  Jilin Normal University
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Microscopic structure of electrode/electrolyte interface probed by molecular simulation and sum frequency generation spectroscopy2019
- Author(s)
  L. Wang、S. Nihonyanagi、K. Inoue、K. Nishikawa、 A. Morita、S. Ye、T. Tahara
- Organizer
  Workshop on Nonlinear Optics at Interfaces 2019
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 大規模QM/MM 法によるPSIIマンガンクラスターの酸化自由エネルギー解析2019
- Author(s)
  高橋英明、鈴岡大樹、森田明弘
- Organizer
  日本コンピュータ化学会2019秋季年会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 油水界面における相間移動触媒の微視的研究2019
- Author(s)
  小泉愛、田原寛文、平野智倫、岸本直樹、森田明弘
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Microscopic structure and dynamics at water-oil interfaces2019
- Author(s)
  A. Morita
- Organizer
  CECAM Workshop on "Dynamics of Water in Complex Environments, Bridging the Gap between Molecular and Mesoscopic Interfaces
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] QM/MM-ER法によるPSIIマンガンクラスターの光酸化の自由エネルギー解析2019
- Author(s)
  高橋英明、鈴岡大樹、森田明弘
- Organizer
  第13回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Ion transport mechanisms through liquid-liquid interfaces2019
- Author(s)
  A. Morita
- Organizer
  Gordon Research Conference on Chemistry and Physics of Liquids
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Theory of χ(3) Effect in Sum Frequency Generation Spectroscopy2018
- Author(s)
  A. Morita
- Organizer
  8th SFG Symposium
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 分子シミュレーションによる気液界面の構造と反応の研究2018
- Author(s)
  森田明弘
- Organizer
  「自然科学における階層と全体」シンポジウム
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 液液界面における電子移動反応機構の多次元自由エネルギー計算2018
- Author(s)
  平野智倫、森田明弘
- Organizer
  第32回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 分子動力学シミュレーションによるアクリレートポリマー/水界面の分子構造の解明2018
- Author(s)
  岸中翔、森田明弘、石山達也
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 実験と理論計算による溶液界面の分子科学の進展2018
- Author(s)
  森田明弘
- Organizer
  ワークショップ「複合系の理論化学・計算化学：最近の研究状況と展望」
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 拡張型QM/MM法の方法論開発とその応用2018
- Author(s)
  高橋英明、神戸宏之、森田明弘
- Organizer
  第21回理論化学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 油水界面における塩基触媒反応の理論研究2018
- Author(s)
  小泉愛、田原寛文、平野智倫、Wang Lingjian、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Structural Transition and Acceleration of H-D Exchange Reaction at Topmost Surface of Hexagonal Ice2018
- Author(s)
  杉本敏樹、大槻友志、加藤史明、石山達也、森田明弘、渡邊一也、松本吉泰
- Organizer
  日本化学会第98春季年会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] コンピュータシミュレーションと理論化学2018
- Author(s)
  森田明弘
- Organizer
  第12回分子シミュレーションスクール―基礎から応用まで―
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theory of χ(3) Effect in Sum Frequency Generation Spectroscopy2018
- Author(s)
  A. Morita
- Organizer
  8th SFG Symposium
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Ion Effects on Third-Order Susceptibility in Sum Frequency Generation Spectroscopy of Aqueous Salt Solutions2018
- Author(s)
  城塚達也、森田明弘
- Organizer
  日本化学会第98春季年会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 油水界面における電子移動反応機構の多次元自由エネルギー計算による理論的解析2018
- Author(s)
  平野智倫、Lingjian Wang 、田原寛文、小泉愛、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Detecting degree of structural order of Langmuir monolayers through molecular simulation analysis of sum frequency generation spectroscopy2018
- Author(s)
  王琳、森田明弘
- Organizer
  第32回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液液界面でのイオン輸送におけるイオンペア形成効果の微視的解明2018
- Author(s)
  田原寛文、Wang Lingjian、平野智倫、小泉愛、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 拡張型QM/MM法の方法論開発とその性能評価2018
- Author(s)
  髙橋英明、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Microscopic Structure and Dynamics at Liquid-Liquid Interfaces2018
- Author(s)
  A. Morita
- Organizer
  Melbourne-Tohoku Workshop: combining Materials Science and Chemistry
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] アクリレートポリマー/水界面における分子構造と振動和周波スペクトルの分子動力学シミュレーション2018
- Author(s)
  岸中翔、森田明弘、石山達也
- Organizer
  第32回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子シミュレーションによる気液界面の構造と反応の研究2018
- Author(s)
  森田明弘
- Organizer
  「自然科学における階層と全体」シンポジウム
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 拡張型QM/MM法の方法論開発とその性能評価2018
- Author(s)
  髙橋英明、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液液界面でのイオン輸送におけるイオンペア形成効果の微視的解明2018
- Author(s)
  田原寛文、Lingjian Wang、平野智倫、小泉愛、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 溶液系の気液界面におけるグランドカノニカル分子動力学法の開発2018
- Author(s)
  内藤暢也、田原寛文、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Recent Topics on Theoretical Analysis of Sum Frequency Generation Spectroscopy2018
- Author(s)
  A. Morita
- Organizer
  Gordon Research Conference on Vibrational Spectroscopy
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Identification of ordered and disordered Langmuir films through computational sum frequency generation spectroscopy2018
- Author(s)
  王琳、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 自由エネルギー計算による親水性イオンの界面間輸送プロセスにおける水和効果の究明2018
- Author(s)
  Lingjian Wang、吉川信明、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 拡張型QM/MM法の方法論開発とその応用2018
- Author(s)
  高橋英明、神戸宏之、森田明弘
- Organizer
  第21回理論化学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 油水界面における塩基触媒反応の理論研究2018
- Author(s)
  小泉愛、田原寛文、平野智倫、Lingjian Wang、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] アクリレートポリマー/水界面における分子構造と振動和周波スペクトルの分子動力学シミュレーション2018
- Author(s)
  岸中翔、森田明弘、石山達也
- Organizer
  第32回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Theoretical Analysis of Structure and Dynamics at Liquid-Liquid Interfaces2018
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on "Hydrophobicity: From Theory, to Simulation, to Experiment"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液体界面の計算分子科学と分光計測2018
- Author(s)
  森田明弘
- Organizer
  第22回分子シミュレーション夏の学校
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] アルコール単分子膜/水溶液界面での酸解離に関する分子動力学シミュレーション2018
- Author(s)
  吉田俊将、城塚達也、森田明弘、石山達也
- Organizer
  第32回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] アモルファスシリカ・水界面の分子動力学シミュレーション2018
- Author(s)
  城塚達也、小幡恭子、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Identification of ordered and disordered Langmuir films through computational sum frequency generation spectroscopy2018
- Author(s)
  王琳、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液液界面における電子移動反応機構の多次元自由エネルギー計算2018
- Author(s)
  平野智倫、森田明弘
- Organizer
  第32回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] アモルファスシリカ・水界面の分子動力学シミュレーション2018
- Author(s)
  城塚達也、小幡恭子、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによるアルコール単分子膜/水溶液界面での酸解離定数の決定2018
- Author(s)
  吉田俊将、森田明弘、石山達也
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 油水界面における電子移動反応機構の多次元自由エネルギー計算による理論的解析2018
- Author(s)
  平野智倫、Lingjian Wang、田原寛文、小泉愛、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 和周波発生分光におけるバルク四重極効果の検討2018
- Author(s)
  森渉、近藤正人、奥野将成、王琳、石橋孝章、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Molecular Dynamics Simulations of Amorphous Silica/Water Interfaces2018
- Author(s)
  T. Joutsuka, K. Obata and A. Morita
- Organizer
  EMLG/JMLG Meeting 2018
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] QM/MM法による水表面における酢酸の酸性度の自由エネルギー解析2018
- Author(s)
  高橋英明、劉斯璋、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Analysis of SFG Spectra of Liquid Interfaces2018
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on "Nonlinear Optics at Interfaces"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Detecting degree of structural order of Langmuir monolayers through molecular simulation analysis of sum frequency generation spectroscopy2018
- Author(s)
  王琳、森田明弘
- Organizer
  第32回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Ion Effects on Third-Order Susceptibility in Sum Frequency Generation Spectroscopy of Aqueous Salt Solutions2018
- Author(s)
  城塚達也、森田明弘
- Organizer
  日本化学会第98春季年会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによるアルコール単分子膜/水溶液界面での酸解離定数の決定2018
- Author(s)
  吉田俊将、森田明弘、石山達也
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Theoretical Analysis on Mechanism of Electron Transfer at Oil/Water Interfaces by Multidimensional Free Energy Calculations2018
- Author(s)
  T. Hirano, L.-J. Wang, H. Tahara, A. Koizumi, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2018
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] コンピュータシミュレーションと理論化学2018
- Author(s)
  森田明弘
- Organizer
  第12回分子シミュレーションスクール～基礎から応用まで～
- Invited
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 自由エネルギー計算による親水性イオンの界面間輸送プロセスにおける水和効果の究明2018
- Author(s)
  Lingjian Wang、吉川信明、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Theoretical Analysis on Mechanism of Electron Transfer at Oil/Water Interfaces by Multidimensional Free Energy Calculations2018
- Author(s)
  NT KHirano, L.-J. Wang, H. Tahara, A. Koizumi, and A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2018
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 溶液系の気液界面におけるグランドカノニカル分子動力学法の開発2018
- Author(s)
  内藤暢也、田原寛文、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theoretical Analysis of Structure and Dynamics at Liquid-Liquid Interfaces2018
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on "Hydrophobicity: From Theory, to Simulation, to Experiment"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Analysis of SFG Spectra of Liquid Interfaces2018
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on "Nonlinear Optics at Interfaces"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによるアクリレートポリマー/水界面の分子構造の解明2018
- Author(s)
  岸中翔、森田明弘、石山達也
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] 液体界面の計算分子科学と分光計測2018
- Author(s)
  森田明弘
- Organizer
  第22回分子シミュレーション夏の学校
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 実験と理論計算による溶液界面の分子科学の進展2018
- Author(s)
  森田明弘
- Organizer
  ワークショップ「複合系の理論化学・計算化学：最近の研究状況と展望」
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] HD-VSFG分光法による空気／陽・陰イオン性混合界面活性剤水溶液界面の水分子の配向の研究2018
- Author(s)
  佐々木伸一、奥野将成、石山達也、森田明弘、石橋孝章
- Organizer
  第4回TIA光・量子計測シンポジウム
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Structural Transition and Acceleration of H-D Exchange Reaction at Topmost Surface of Hexagonal Ice2018
- Author(s)
  杉本敏樹、大槻友志、加藤史明、石山達也、森田明弘、渡邊一也、松本吉泰
- Organizer
  日本化学会第98春季年会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波発生分光におけるバルク四重極効果の検討2018
- Author(s)
  森渉、近藤正人、奥野将成、王琳、石橋孝章、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Microscopic Structure and Dynamics at Liquid-Liquid Interfaces2018
- Author(s)
  A. Morita
- Organizer
  Melbourne-Tohoku Workshop: combining Materials Science and Chemistry
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18H05265
[Presentation] Recent Topics on Theoretical Analysis of Sum Frequency Generation Spectroscopy2018
- Author(s)
  A. Morita
- Organizer
  Gordon Research Conference on Vibrational Spectroscopy
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Molecular Dynamics Simulations of Amorphous Silica/Water Interfaces2018
- Author(s)
  T. Joutsuka, K. Obata and A. Morita
- Organizer
  EMLG/JMLG Meeting 2018
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] QM/MM法による水表面における酢酸の酸性度の自由エネルギー解析2018
- Author(s)
  高橋英明、劉斯璋、森田明弘
- Organizer
  第12回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] アルコール単分子膜/水溶液界面での酸解離に関する分子動力学シミュレーション2018
- Author(s)
  吉田俊将、城塚達也、森田明弘、石山達也
- Organizer
  第32回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] QM/MM法による水溶液中のATP加水分解反応の自由エネルギー解析2017
- Author(s)
  高橋英明、海野悟、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 液体界面の分子科学2017
- Author(s)
  森田明弘
- Organizer
  お茶の水女子大学セミナー
- Place of Presentation
  お茶の水女子大学 (東京都文京区）
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] アルコール単分子膜/水溶液界面でのイオン分布2017
- Author(s)
  吉田俊将、森田明弘、石山達也
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] アクリレートポリマー/水界面における水の水素結合構造2017
- Author(s)
  岸中翔、八十島亘宏、森田明弘、石山達也
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Unified Assignment of Alkyl C-H Vibrational Spectra of Ethanol by Molecular Dynamics Simulation2017
- Author(s)
  王琳、石山達也、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Theory of Ion Transport at Oil-Water Interfaces2017
- Author(s)
  Akihiro Morita
- Organizer
  13th International Conference of Computational Methods in Sciences and Engineering (ICCMSE2017)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Distribution of hydrated ion clusters near liquid-liquid interface2017
- Author(s)
  Lingjian Wang, Nobuaki Kikkawa, and Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2017
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 氷表面の分子動力学シミュレーション：フリーOH振動の和周波発生スペクトル強度と表面環構造との関係について2017
- Author(s)
  石山達也、大槻友志、杉本敏樹、森田明弘、渡邉一也、松本吉泰
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Effect of Third-Order Susceptibility in Sum Frequency Generation Spectroscopy: Molecular Dynamics Study in Liquid Water2017
- Author(s)
  Tatsuya Joutsuka, Tomonori Hirano, Michiel Sprik, Akihiro Morita
- Organizer
  KAKENHI International Symposium on "Studying the Function of Soft Molecular Systems"
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Structure and Reactivity at Aqueous Interfaces2017
- Author(s)
  Akihiro Morita
- Organizer
  3rd International Workshop on Heterogeneous Kinetics
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 液液界面における Facilitated Ion Transfer の微視的機構2017
- Author(s)
  田原寛文、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 氷表面の分子動力学シミュレーション：フリーOH振動の和周波発生スペクトル強度と表面環構造との関係について2017
- Author(s)
  石山達也、大槻友志、杉本敏樹、森田明弘、渡邉一也、松本吉泰
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによる油水界面での電子移動機構の研究2017
- Author(s)
  平野智倫、杉林敏大、田原寛文、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] アクリレート系高分子と水界面の分子動力学シミュレーション2017
- Author(s)
  岸中翔、八十島亘弘、森田明弘、石山達也
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 固液界面におけるイオン移動と振動差スペクトルの分子動力学シミュレーション2017
- Author(s)
  城塚達也、高瀬航輝、森田明弘
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Free Energy Analyses for the Hydrolysis of ATP in Water Solution Through Quantum Chemical Simulations2017
- Author(s)
  Hideaki Takahashi, Satoru Umino, Akihiro Morita
- Organizer
  1st International Symposium on Fuels and Energy
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Distribution of hydrated ion clusters near liquid-liquid interface2017
- Author(s)
  Lingjian Wang, Nobuaki Kikkawa, and Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2017
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] アクリレート系高分子と水界面の分子動力学シミュレーション2017
- Author(s)
  岸中翔、八十島亘弘、森田明弘、石山達也
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Effect of Third-Order Susceptibility in Sum Frequency Generation Spectroscopy: Molecular Dynamics Study in Liquid Water2017
- Author(s)
  Tatsuya Joutsuka, Tomonori Hirano, Michiel Sprik, Akihiro Morita
- Organizer
  KAKENHI International Symposium on "Studying the Function of Soft Molecular Systems"
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Free Energy Analyses for the Hydrolysis of ATP in Water Solution Through Quantum Chemical Simulations2017
- Author(s)
  Hideaki Takahashi, Satoru Umino, Akihiro Morita
- Organizer
  1st International Symposium on Fuels and Energy
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液液界面で起こるイオン輸送過程の水和状態に関する研究2017
- Author(s)
  Lingjian Wang、吉川信明、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Structure and Reactivity at Aqueous Interfaces2017
- Author(s)
  Akihiro Morita
- Organizer
  3rd International Workshop on Heterogeneous Kinetics
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 和周波発生分光法における三次感受率の効果：水の分子動力学シミュレーションによる研究2017
- Author(s)
  城塚達也、平野智倫、Michiel Sprik、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波発生分光法における三次の感受率の効果：水の分子動力学シミュレーションによる研究2017
- Author(s)
  城塚達也、平野智倫、Michiel Sprik、森田明弘
- Organizer
  第20回理論化学討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Recent Topics in Theoretical Analysis of Sum Frequency Generation Spectroscopy2017
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference in China (TSRC2) on Nonlinear Optics at Interface
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Unified assignment method of alkyl C-H vibrational spectra: molecular dynamics study of ethanol2017
- Author(s)
  Lin Wang, Tatsuya Ishiyama and Akihiro Morita
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液体界面の分子科学2017
- Author(s)
  森田明弘
- Organizer
  日本物理学会第72回年次大会
- Place of Presentation
  大阪大学豊中キャンパス (大阪府豊中市)
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Unified assignment method of alkyl C-H vibrational spectra: molecular dynamics study of ethanol2017
- Author(s)
  Lin Wang, Tatsuya Ishiyama and Akihiro Morita
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and Efficient Computation of Difference Vibrational Spectroscopy2017
- Author(s)
  Akihiro Morita
- Organizer
  9th International Conference on Advanced Vibrational Spectroscopy (ICAVS2017)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theory of structure and functions of liquid and polymer interfaces2017
- Author(s)
  Akihiro Morita
- Organizer
  KAKENHI International Symposium on "Studying the Function of Soft Molecular Systems"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theory and Efficient Computation of Difference Vibrational Spectroscopy2017
- Author(s)
  Akihiro Morita
- Organizer
  9th International Conference on Advanced Vibrational Spectroscopy (ICAVS2017)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Theory of Ion Transport at Oil-Water Interfaces2017
- Author(s)
  Akihiro Morita
- Organizer
  13th International Conference of Computational Methods in Sciences and Engineering (ICCMSE2017)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液体界面の分子科学2017
- Author(s)
  森田明弘
- Organizer
  日本物理学会第72回年次大会
- Place of Presentation
  大阪大学豊中キャンパス (大阪府豊中市)
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] アクリレートポリマー/水界面における水の水素結合構造2017
- Author(s)
  岸中翔、八十島亘宏、森田明弘、石山達也
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Recent Topics in Theoretical Analysis of Sum Frequency Generation Spectroscopy2017
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference in China (TSRC2) on Nonlinear Optics at Interface
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory of structure and functions of liquid and polymer interfaces2017
- Author(s)
  Akihiro Morita
- Organizer
  KAKENHI International Symposium on "Studying the Function of Soft Molecular Systems"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 実験と理論の協奏で拓く水表面の和周波分光研究の最先端2017
- Author(s)
  森田明弘、田原太平
- Organizer
  日本化学会第97春季年会シンポジウム「複雑系のための分子科学－理論、計測、合成の連携で拓く柔らかな分子の新機能」
- Place of Presentation
  慶應義塾大学　日吉キャンパス (神奈川県横浜市）
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Unified Assignment of Alkyl C-H Vibrational Spectra of Ethanol by Molecular Dynamics Simulation2017
- Author(s)
  王琳、石山達也、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 和周波発生分光法における三次感受率の効果：水の分子動力学シミュレーションによる研究2017
- Author(s)
  城塚達也、平野智倫、Michiel Sprik、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによる油水界面での電子移動機構の研究2017
- Author(s)
  平野智倫、杉林敏大、田原寛文、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液液界面で起こるイオン輸送過程の水和状態に関する研究2017
- Author(s)
  Lingjian Wang、吉川信明、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液液界面における Facilitated Ion Transfer の微視的機構2017
- Author(s)
  田原寛文、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] アルコール単分子膜/水溶液界面でのイオン分布2017
- Author(s)
  吉田俊将、森田明弘、石山達也
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波発生分光法における三次の感受率の効果：水の分子動力学シミュレーションによる研究2017
- Author(s)
  城塚達也、平野智倫、Michiel Sprik、森田明弘
- Organizer
  第20回理論化学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液体界面の分子科学2017
- Author(s)
  森田明弘
- Organizer
  お茶の水女子大学セミナー
- Place of Presentation
  お茶の水女子大学 (東京都文京区）
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 氷表面における環構造の温度依存性2017
- Author(s)
  石山達也、森田明弘
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] QM/MM法による水溶液中のATP加水分解反応の自由エネルギー解析2017
- Author(s)
  高橋英明、海野悟、森田明弘
- Organizer
  第11回分子科学討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 固液界面におけるイオン移動と振動差スペクトルの分子動力学シミュレーション2017
- Author(s)
  城塚達也、高瀬航輝、森田明弘
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 氷表面における環構造の温度依存性2017
- Author(s)
  石山達也、森田明弘
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Microscopic Structure of Organic Electrolyte Interface by Molecular Dynamics and Sum Frequency Generation Spectroscopy2016
- Author(s)
  L. Wang and A. Morita
- Organizer
  4th International Conference on Molecular Simulation (ICMS2016)
- Place of Presentation
  Shanghai, China
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 和周波発生分光法における三次感受率の効果：水の分子動力学シミュレーションによる研究2016
- Author(s)
  城塚達也、森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第4回公開シンポジウム
- Place of Presentation
  名古屋工業大学４号館ホール（愛知県名古屋市）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Heterodyne-detected sum frequency generation spectroscopy of ice surface2016
- Author(s)
  Y. Otsuki, T. Sugimoto, T. Ishiyama, A. Morita, K. Watanabe, and Y. Matsumoto
- Organizer
  第7回SFG研究会「和周波分光の進展」
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 空気/水界面における二次元和周波スペクトルの分子動力学計算2016
- Author(s)
  石山達也，森田明弘
- Organizer
  第19回理論化学討論会
- Place of Presentation
  早稲田大学西早稲田キャンパス（東京都新宿区）
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] IV-SFG and Molecular Dynamics Simulation Studies on Liquid/liquid2016
- Author(s)
  岩橋崇、石山達也、森田明弘、Kim Doseok、大内幸雄
- Organizer
  7th SFG workshop
- Place of Presentation
  東京工業大学大岡山キャンパス
- Year and Date
  2016-06-10
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26248004
[Presentation] Ion Transport Mechanism at Liquid-Liquid Interface2016
- Author(s)
  N. Kikkawa, L.-J. Wang, and A. Morita
- Organizer
  4th International Conference on Molecular Simulation (ICMS2016)
- Place of Presentation
  Shanghai, China
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Microscopic Structure of Organic Electrolyte Interface by Molecular Dynamics and Sum Frequency Generation Spectroscopy2016
- Author(s)
  L. Wang and A. Morita
- Organizer
  4th International Conference on Molecular Simulation (ICMS2016)
- Place of Presentation
  Shanghai, China
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical Analysis of SFG Spectroscopy --- Recent Topics2016
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride, CO, USA
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 溶液・高分子系界面の構造および機能の理論解析2016
- Author(s)
  森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第4回公開シンポジウム
- Place of Presentation
  名古屋工業大学４号館ホール（愛知県名古屋市）
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 油水界面における電子移動反応の分子シミュレーションによる探求2016
- Author(s)
  杉林敏大、L.-J. Wang、吉川信明、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子動力学シミュレーションによる双性イオンリン脂質膜近傍における水の水素結合構造と振動分光解析2016
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  第65回高分子学会年次大会
- Place of Presentation
  神戸国際会議場（兵庫県神戸市）
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液液界面のイオン輸送における水和と蒸発の効果2016
- Author(s)
  L.-J. Wang、吉川信明、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 理論と実験の協力による溶液界面化学の研究2016
- Author(s)
  森田明弘
- Organizer
  名古屋大学セミナー
- Place of Presentation
  名古屋大学（愛知県名古屋市）
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] QM/MM-ER法による光化学系IIのMnクラスターにおける一電子酸化反応の自由エネルギー解析2016
- Author(s)
  鈴岡大樹、高橋英明、森田明弘
- Organizer
  第30回分子シミュレーション討論会
- Place of Presentation
  大阪大学豊中キャンパスシグマホール (大阪府豊中市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Computational SFG analysis of organic molecules2016
- Author(s)
  L. Wang and A. Morita
- Organizer
  第7回SFG研究会「和周波分光の進展」
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] QM/MM-ER法による光化学系IIのMnクラスターにおける一電子酸化反応の自由エネルギー解析2016
- Author(s)
  鈴岡大樹、高橋英明、森田明弘
- Organizer
  第30回分子シミュレーション討論会
- Place of Presentation
  大阪大学豊中キャンパスシグマホール (大阪府豊中市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Computational Analysis of Sum Frequency Generation Spectroscopy2016
- Author(s)
  A. Morita
- Organizer
  invited lecture at Fudan University
- Place of Presentation
  Shanghai, China
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Rh(111)上の常誘電氷表面の和周波発生振動分光2016
- Author(s)
  大槻友志、杉本敏樹、石山達也、森田明弘、渡邊一也、松本吉泰
- Organizer
  第14回京都大学低温物質科学研究センター講演会・研究交流会
- Place of Presentation
  京都大学百周年時計台記念館国際交流ホールII、III （京都府京都市）
- Year and Date
  2016-02-19
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Microscopic Structure and Uptake Kinetics at Aqueous Solution Surfaces2016
- Author(s)
  Akihiro. Morita and Tatsuya Ishiyama
- Organizer
  251st ACS National Meeting, Symposium on "Physical Chemistry of Complex Environmental Interfaces,"
- Place of Presentation
  San Diego, CA, USA
- Year and Date
  2016-03-13
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Computational SFG analysis of organic molecules2016
- Author(s)
  L. Wang and A. Morita
- Organizer
  第7回SFG研究会「和周波分光の進展」
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 加藤先生から学んだ理論化学とその発展2016
- Author(s)
  森田明弘
- Organizer
  第5回研究会「化学反応のポテンシャル曲面とダイナミックス」
- Place of Presentation
  京都大学理学研究科セミナーハウス（京都府京都市）
- Year and Date
  2016-03-28
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Computational Analysis of Sum Frequency Generation Spectroscopy2016
- Author(s)
  A. Morita
- Organizer
  invited lecture at Fudan University
- Place of Presentation
  Shanghai, China
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theoretical Analysis of SFG Spectroscopy --- Recent Topics2016
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride, CO, USA
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 水/アセトニトリル溶液の界面配向構造解析に関する理論的および実験的研究2016
- Author(s)
  齋藤健吾、王琳、城塚達也、石山達也、彭奇齢、叶深、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] MD計算とSFG分光による有機カーボネート表面構造の研究2016
- Author(s)
  王琳、彭奇齢、叶深、森田明弘
- Organizer
  第19回理論化学討論会
- Place of Presentation
  早稲田大学西早稲田キャンパス（東京都新宿区）
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 加藤先生から学んだ理論化学とその発展2016
- Author(s)
  森田明弘
- Organizer
  第5回研究会「化学反応のポテンシャル曲面とダイナミックス」
- Place of Presentation
  京都大学理学研究科セミナーハウス（京都府京都市）
- Year and Date
  2016-03-28
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによる温度・圧力制御下での振動差スペクトルの効率的な計算手法と水への応用2016
- Author(s)
  城塚達也、森田明弘
- Organizer
  第30回分子シミュレーション討論会
- Place of Presentation
  大阪大学豊中キャンパスシグマホール (大阪府豊中市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 実空間DFTにおけるハイブリッド汎関数の実装とその応用2016
- Author(s)
  高橋英明、神戸宏之、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 温度・圧力制御下での振動差スペクトルの効率的な計算アルゴリズム2016
- Author(s)
  城塚達也、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Ion Transport Mechanism at Liquid-Liquid Interface2016
- Author(s)
  N. Kikkawa, L.-J. Wang, and A. Morita
- Organizer
  4th International Conference on Molecular Simulation (ICMS2016)
- Place of Presentation
  Shanghai, China
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子動力学シミュレーションによる温度・圧力制御下での振動差スペクトルの効率的な計算手法と水への応用2016
- Author(s)
  城塚達也、森田明弘
- Organizer
  第30回分子シミュレーション討論会
- Place of Presentation
  大阪大学豊中キャンパスシグマホール (大阪府豊中市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 理論と実験の協力による溶液界面化学の研究2016
- Author(s)
  森田明弘
- Organizer
  名古屋大学セミナー
- Place of Presentation
  名古屋大学（愛知県名古屋市）
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 温度・圧力制御下での振動差スペクトルの効率的な計算アルゴリズム2016
- Author(s)
  城塚達也、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Recent Development of Computational Analysis on Vibrational Sum Frequency Generation Spectroscopy2016
- Author(s)
  Akihiro Morita
- Organizer
  CECAM Workshop "Liquid/Solid Interfaces: Structure and dynamics from spectroscopy and simulations - 3rd Edition"
- Place of Presentation
  Lausanne, Switzerland
- Year and Date
  2016-01-25
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] MD計算とSFG分光による有機カーボネート表面構造の研究2016
- Author(s)
  王琳、彭奇齢、叶深、森田明弘
- Organizer
  第19回理論化学討論会
- Place of Presentation
  早稲田大学西早稲田キャンパス（東京都新宿区）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Dynamics Simulation of Time-Resolved Vibrational Spectroscopy at Air/Water Interface2016
- Author(s)
  T. Ishiyama and A. Morita
- Organizer
  4th International Conference on Molecular Simulation (ICMS2016)
- Place of Presentation
  Shanghai, China
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Comparison of Hydrogen Bonding Structure of Water near Lipid and Surfactant Monolayer Interfaces by Molecular Dynamics Simulation2016
- Author(s)
  D. Terada, T. Ishiyama, and A. Morita
- Organizer
  4th International Conference on Molecular Simulation (ICMS2016)
- Place of Presentation
  Shanghai, China
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 赤外-可視和周波発生振動分光法と分子動力学計算を用いたイオン液体/アルコール界面構造の研究2016
- Author(s)
  岩橋崇、石山達也、森田明弘、Kim Doseok、大内幸雄
- Organizer
  第7回イオン液体討論会
- Place of Presentation
  金沢市文化ホール
- Year and Date
  2016-10-24
- Data Source
  KAKENHI-PROJECT-26248004
[Presentation] 異なる双性イオン膜/水界面における水の水素結合構造比較2016
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 赤外-可視和周波発生振動分光法と分子動力学計算を用いたイオン液体/アルコール界面構造の研究2016
- Author(s)
  岩橋崇、石山達也、森田明弘、Kim Doseok、大内幸雄
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 異なる双性イオン膜/水界面における水の水素結合構造比較2016
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 液体界面を見る分子科学の進歩2016
- Author(s)
  森田明弘
- Organizer
  第3回森野ディスカッション
- Place of Presentation
  東京大学理学部・本郷キャンパス・小柴ホール（東京都文京区）
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 空気/水界面における二次元和周波スペクトルの分子動力学計算2016
- Author(s)
  石山達也，森田明弘
- Organizer
  第19回理論化学討論会
- Place of Presentation
  早稲田大学西早稲田キャンパス（東京都新宿区）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 溶液界面のプローブ手法と分子シミュレーション2016
- Author(s)
  森田明弘
- Organizer
  第28回液体の化学夏の学校
- Place of Presentation
  大学セミナーハウス (東京都八王子市)
- Year and Date
  2016-08-29
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Efficient Computational Algorithm of Vibrational Difference Spectra under Control of Temperature and Pressure2016
- Author(s)
  T. Joutsuka and A. Morita
- Organizer
  International Symposium on Multi-scale Simulation of Condensed-phase Reacting Systems (MSCRS2016)
- Place of Presentation
  Nagoya, Japan
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Recent Development of Computational Analysis on Vibrational Sum Frequency Generation Spectroscopy2016
- Author(s)
  Akihiro Morita
- Organizer
  CECAM Workshop "Liquid/Solid Interfaces: Structure and dynamics from spectroscopy and simulations - 3rd Edition"
- Place of Presentation
  Lausanne, Switzerland
- Year and Date
  2016-01-25
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Microscopic Structure and Uptake Kinetics at Aqueous Solution Surfaces2016
- Author(s)
  Akihiro. Morita and Tatsuya Ishiyama
- Organizer
  251st ACS National Meeting, Symposium on "Physical Chemistry of Complex Environmental Interfaces,"
- Place of Presentation
  San Diego, CA, USA
- Year and Date
  2016-03-13
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液液界面のイオン輸送における水和と蒸発の効果2016
- Author(s)
  L.-J. Wang、吉川信明、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Comparison of Hydrogen Bonding Structure of Water near Lipid and Surfactant Monolayer Interfaces by Molecular Dynamics Simulation2016
- Author(s)
  D. Terada, T. Ishiyama, and A. Morita
- Organizer
  4th International Conference on Molecular Simulation (ICMS2016)
- Place of Presentation
  Shanghai, China
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Rh(111)上の常誘電氷表面の和周波発生振動分光2016
- Author(s)
  大槻友志、杉本敏樹、石山達也、森田明弘、渡邊一也、松本吉泰
- Organizer
  第14回京都大学低温物質科学研究センター講演会・研究交流会
- Place of Presentation
  京都大学百周年時計台記念館国際交流ホールII、III （京都府京都市）
- Year and Date
  2016-02-19
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Heterodyne-detected sum frequency generation spectroscopy of ice surface2016
- Author(s)
  Y. Otsuki, T. Sugimoto, T. Ishiyama, A. Morita, K. Watanabe, and Y. Matsumoto
- Organizer
  第7回SFG研究会「和周波分光の進展」
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 和周波発生振動分光による結晶氷表面の水素結合構造の解明2016
- Author(s)
  杉本敏樹、大槻友志、石山達也、森田明弘、渡邊一也、松本吉泰
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Microscopic Structure and Uptake Kinetics at Aqueous Surfaces2016
- Author(s)
  A. Morita
- Organizer
  2nd International Workshop on Heterogeneous Kinetics Related to Atmospheric Aerosols
- Place of Presentation
  Tsukuba, Japan
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 液体界面を見る分子科学の進歩2016
- Author(s)
  森田明弘
- Organizer
  第3回森野ディスカッション
- Place of Presentation
  東京大学理学部・本郷キャンパス・小柴ホール（東京都文京区）
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 溶液界面のプローブ手法と分子シミュレーション2016
- Author(s)
  森田明弘
- Organizer
  第28回液体の化学夏の学校
- Place of Presentation
  大学セミナーハウス (東京都八王子市)
- Year and Date
  2016-08-29
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波発生振動分光による結晶氷表面の水素結合構造の解明2016
- Author(s)
  杉本敏樹、大槻友志、石山達也、森田明弘、渡邊一也、松本吉泰
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Efficient Computational Algorithm of Vibrational Difference Spectra under Control of Temperature and Pressure2016
- Author(s)
  T. Joutsuka and A. Morita
- Organizer
  International Symposium on Multi-scale Simulation of Condensed-phase Reacting Systems (MSCRS2016)
- Place of Presentation
  Nagoya, Japan
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Microscopic Structure and Uptake Kinetics at Aqueous Surfaces2016
- Author(s)
  A. Morita
- Organizer
  2nd International Workshop on Heterogeneous Kinetics Related to Atmospheric Aerosols
- Place of Presentation
  Tsukuba, Japan
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによる双性イオンリン脂質膜近傍における水の水素結合構造と振動分光解析2016
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  第65回高分子学会年次大会
- Place of Presentation
  神戸国際会議場（兵庫県神戸市）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 赤外-可視和周波発生振動分光法と分子動力学計算を用いたイオン液体/アルコール界面構造の研究2016
- Author(s)
  岩橋崇、石山達也、森田明弘、Kim Doseok、大内幸雄
- Organizer
  第10回分子科学討論会2016
- Place of Presentation
  神戸ファッションマート
- Year and Date
  2016-09-13
- Data Source
  KAKENHI-PROJECT-26248004
[Presentation] Molecular Dynamics Simulation of Time-Resolved Vibrational Spectroscopy at Air/Water Interface2016
- Author(s)
  T. Ishiyama and A. Morita
- Organizer
  4th International Conference on Molecular Simulation (ICMS2016)
- Place of Presentation
  Shanghai, China
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 水/アセトニトリル溶液の界面配向構造解析に関する理論的および実験的研究2016
- Author(s)
  齋藤健吾、王琳、城塚達也、石山達也、彭奇齢、叶深、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 実空間DFTにおけるハイブリッド汎関数の実装とその応用2016
- Author(s)
  高橋英明、神戸宏之、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 油水界面における電子移動反応の分子シミュレーションによる探求2016
- Author(s)
  杉林敏大、L.-J. Wang、吉川信明、森田明弘
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 赤外-可視和周波発生振動分光法と分子動力学計算を用いたイオン液体/アルコール界面構造の研究2016
- Author(s)
  岩橋崇、石山達也、森田明弘、Kim Doseok、大内幸雄
- Organizer
  第10回分子科学討論会
- Place of Presentation
  神戸ファッションマート (兵庫県神戸市)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Dynamics Study of Heterogeneous Kinetics and Reactions2015
- Author(s)
  Akihiro Morita
- Organizer
  International Workshop on Heterogeneous Kinetics Related to Atmospheric Aerosols
- Place of Presentation
  Beijing, China
- Year and Date
  2015-08-10
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] QM/MM法による溶質分子の電子密度揺らぎにおける軌道間の相関の解析2015
- Author(s)
  鈴岡大樹、高橋英明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 静的相関をシミュレートする電子交換汎関数の開発と実装2015
- Author(s)
  高橋英明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-16
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Two-Dimensional Sum Frequency Generation Spectra at Vapor/Water Interface: Molecular Dynamics Simulation Study2015
- Author(s)
  Tatsuya Ishiyama, Akihiro Morita, and Tahei.Tahara
- Organizer
  Pacifichem 2015, Symposium on "Recent Experimental and Theoretical Advances in Studies of Liquid Interfaces"
- Place of Presentation
  Honolulu, HI, USA
- Year and Date
  2015-12-19
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Vibrational Spectroscopic Study of Lipid/Water Interface by Molecular Dynamics Simulation2015
- Author(s)
  Tatsuya Ishiyama, Daichi Terada, and Akihiro Morita
- Organizer
  Pacifichem 2015, Symposium on "Recent Experimental and Theoretical Advances in Studies of Liquid Interfaces"
- Place of Presentation
  Honolulu, HI, USA
- Year and Date
  2015-12-19
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and efficient computation of vibrational difference spectra2015
- Author(s)
  Tatsuya Joutsuka, Akihiro Morita
- Organizer
  249th ACS National Meeting
- Place of Presentation
  Denver, CO, USA
- Year and Date
  2015-03-25
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面構造の座標化による油水界面のイオン輸送の解析2015
- Author(s)
  吉川信明、Lingjian Wang、森田明弘
- Organizer
  第61回ポーラログラフィーおよび電気分析化学討論会
- Place of Presentation
  イーグレひめじ（兵庫県姫路市）
- Year and Date
  2015-11-24
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによる生体膜/水界面の構造と振動スペクトル解析2015
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  平成27年度日本化学会近畿支部北陸地区講演会
- Place of Presentation
  金沢大学角間キャンパス（石川県金沢市）
- Year and Date
  2015-11-27
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Distribution of Hydrated Ion Clusters Transported through Water-Oil Interface2015
- Author(s)
  Lingjian Wang, Nobuaki Kikkawa, and Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2015
- Place of Presentation
  Sendai, Japan
- Year and Date
  2015-08-27
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] QM/MM法における交換反発ポテンシャルの構築とQM/MM-ER法への応用2015
- Author(s)
  海野悟、高橋英明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-16
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Free energy analysis of hydration of benzene -- Role of OH/π interaction in solvation --2015
- Author(s)
  Hideaki Takahashi, Daiki Suzuoka, and Akihiro Morita
- Organizer
  International Symposium on Soft Molecular Systems
- Place of Presentation
  Tokyo, Japan
- Year and Date
  2015-07-11
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] QM/MM法における交換反発ポテンシャルの構築とQM/MM-ER法への応用2015
- Author(s)
  海野悟、高橋英明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-16
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 水/アセトニトリル溶液の界面配向構造と非線形分極の理論研究2015
- Author(s)
  齋藤健吾、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面構造の座標化による油水界面のイオン輸送の解析2015
- Author(s)
  吉川信明、Lingjian Wang、森田明弘
- Organizer
  第38回溶液化学シンポジウム
- Place of Presentation
  高知市文化プラザかるぽーと（高知県高知市）
- Year and Date
  2015-10-22
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 溶液中の振動差スペクトルの効率的な計算方法2015
- Author(s)
  城塚達也、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-16
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Computational Analysis of Surface Nonlinear Spectroscopy2015
- Author(s)
  Akihiro Morita
- Organizer
  4th Annual World Congress of Advanced Materials-2015 (WCAM-2015)
- Place of Presentation
  Chongqing, China
- Year and Date
  2015-05-28
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面構造の座標化による油水界面のイオン輸送の解析2015
- Author(s)
  吉川信明、Lingjian Wang、森田明弘
- Organizer
  第38回溶液化学シンポジウム
- Place of Presentation
  高知市文化プラザかるぽーと（高知県高知市）
- Year and Date
  2015-10-22
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液液界面付近の水和イオンクラスター分布2015
- Author(s)
  Lingjian Wang、吉川信明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-17
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子動力学シミュレーションによる生体膜/水界面の構造と振動スペクトル解析2015
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  平成27年度日本化学会近畿支部北陸地区講演会
- Place of Presentation
  金沢大学角間キャンパス（石川県金沢市）
- Year and Date
  2015-11-27
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面和周波発生分光の理論と分子シミュレーション2015
- Author(s)
  森田明弘
- Organizer
  日本分光学会・界面部会シンポジウム
- Place of Presentation
  東北大学・青葉山キャンパス（宮城県・仙台市）
- Year and Date
  2015-03-06
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical Analysis on the Methods to Derive Surface Molecular Orientation by Sum Frequency Generation Spectroscopy,2015
- Author(s)
  Akihiro Morita, Takashi. Ishihara, Kengo Saito, Tatsuya Ishiyama, Lin Wang
- Organizer
  249th ACS National Meeting
- Place of Presentation
  Denver, CO, USA
- Year and Date
  2015-03-25
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液体界面の計算分子科学2015
- Author(s)
  森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-16
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Study of Ion Transport through Liquid Interfaces by using Molecular Dynamics Simulation2015
- Author(s)
  Nobuaki Kikkawa, Lingjian Wang, and Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2015
- Place of Presentation
  Sendai, Japan
- Year and Date
  2015-08-27
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水表面における構造と変角振動スペクトルの分子動力学研究2015
- Author(s)
  田中翔悟、石山達也、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-17
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Computational Analysis of Surface Nonlinear Spectroscopy2015
- Author(s)
  Akihiro Morita
- Organizer
  4th Annual World Congress of Advanced Materials-2015 (WCAM-2015)
- Place of Presentation
  Chongqing, China
- Year and Date
  2015-05-28
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Dynamics Simulation of Ion transports through Liquid-Liquid Interface2015
- Author(s)
  Nobuaki Kikkawa, Lingjan Wang, Akihiro Morita
- Organizer
  249th ACS National Meeting
- Place of Presentation
  Denver, CO, USA
- Year and Date
  2015-03-25
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theoretical Analysis of Multi-scale Mass Transfer Kinetics in Droplet Flows2015
- Author(s)
  Akihiro Morita
- Organizer
  EMN Droplets Meeting 2015
- Place of Presentation
  Phuket, Thailand
- Year and Date
  2015-05-10
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical analysis on structure and function of solution and polymer interfaces2015
- Author(s)
  Akihiro Morita
- Organizer
  International Symposium on Soft Molecular Systems
- Place of Presentation
  Tokyo, Japan
- Year and Date
  2015-07-09
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 静的相関をシミュレートする電子交換汎関数の開発と実装2015
- Author(s)
  高橋英明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-16
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 界面和周波発生分光の理論と分子シミュレーション2015
- Author(s)
  森田明弘
- Organizer
  日本分光学会・界面部会シンポジウム
- Place of Presentation
  東北大学・青葉山キャンパス（宮城県・仙台市）
- Year and Date
  2015-03-06
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面構造の座標化による油水界面のイオン輸送の解析2015
- Author(s)
  吉川信明、Lingjian Wang、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-19
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Two-Dimensional Sum Frequency Generation Spectra at Vapor/Water Interface: Molecular Dynamics Simulation Study2015
- Author(s)
  Tatsuya Ishiyama, Akihiro Morita, and Tahei.Tahara
- Organizer
  Pacifichem 2015, Symposium on "Recent Experimental and Theoretical Advances in Studies of Liquid Interfaces"
- Place of Presentation
  Honolulu, HI, USA
- Year and Date
  2015-12-19
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Free energy analysis of hydration of benzene -- Role of OH/π interaction in solvation --2015
- Author(s)
  Hideaki Takahashi, Daiki Suzuoka, and Akihiro Morita
- Organizer
  International Symposium on Soft Molecular Systems
- Place of Presentation
  Tokyo, Japan
- Year and Date
  2015-07-11
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液体界面の計算分子科学2015
- Author(s)
  森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-16
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Recent Computational Studies on Surface Vibrations and Sum Frequency Generation Spectroscopy2015
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference on Vibrational Dynamics
- Place of Presentation
  Telluride, CO, USA
- Year and Date
  2015-07-29
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Recent computational analysis of sum frequency generation spectroscopy.2015
- Author(s)
  Akihiro Morita
- Organizer
  Carnegie Mellon University
- Place of Presentation
  Pittsburgh, PA, USA
- Year and Date
  2015-03-27
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Analyses of the Solvation Free Energies due to Electron Density Fluctuation using QM/MM Method Combined with a Theory of Solutions2015
- Author(s)
  Daiki Suzuoka, Hideaki Takahashi, and Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2015
- Place of Presentation
  Sendai, Japan
- Year and Date
  2015-08-27
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 赤外-可視和周波発生振動分光法を用いたイオン液体/分子性液体界面構造の研究2015
- Author(s)
  岩橋崇、石山達也、酒井康成、森田明弘、Kim Doseok、大内幸雄
- Organizer
  第6回イオン液体討論会
- Place of Presentation
  同志社大学・今出川キャンパス
- Year and Date
  2015-10-26
- Data Source
  KAKENHI-PROJECT-26248004
[Presentation] 液液界面付近の水和イオンクラスター分布2015
- Author(s)
  Lingjian Wang、吉川信明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-17
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Distribution of Hydrated Ion Clusters Transported through Water-Oil Interface2015
- Author(s)
  Lingjian Wang, Nobuaki Kikkawa, and Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2015
- Place of Presentation
  Sendai, Japan
- Year and Date
  2015-08-27
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子動力学シミュレーションによる生体膜/水界面の構造と振動スペクトル解析2015
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical Analysis of Multi-scale Mass Transfer Kinetics in Droplet Flows2015
- Author(s)
  Akihiro Morita
- Organizer
  EMN Droplets Meeting 2015
- Place of Presentation
  Phuket, Thailand
- Year and Date
  2015-05-10
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面構造の座標化による油水界面のイオン輸送の解析、及び、拡張系の方法を用いた電位差一定のアンサンブルの実現2015
- Author(s)
  吉川信明、Lingjian Wang、森田明弘
- Organizer
  第29回分子シミュレーション討論会
- Place of Presentation
  朱鷺メッセ新潟コンベンションセンター（新潟県新潟市）
- Year and Date
  2015-12-01
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子動力学(MD)シミュレーションによる生体膜/水界面の振動スペクトルと水素結合構造2015
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  第29回分子シミュレーション討論会
- Place of Presentation
  朱鷺メッセ新潟コンベンションセンター（新潟県新潟市）
- Year and Date
  2015-12-01
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 溶液界面の分子シミュレーション研究2015
- Author(s)
  森田明弘
- Organizer
  スーパーコンピューターワークショップ2015「様々な対象に応用される計算分子科学」
- Place of Presentation
  自然科学研究機構　岡崎コンファレンスセンター（愛知県・岡崎市）
- Year and Date
  2015-01-30
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Recent Computational Studies on Surface Vibrations and Sum Frequency Generation Spectroscopy2015
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference on Vibrational Dynamics
- Place of Presentation
  Telluride, CO, USA
- Year and Date
  2015-07-29
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面SFG分光の理論計算2015
- Author(s)
  森田明弘
- Organizer
  東京工業大学資源化学研究所講演会
- Place of Presentation
  東京工業大学資源化学研究所（神奈川県・横浜）
- Year and Date
  2015-01-19
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 第一溶媒和殻をQM領域とするQM/MM法と溶液論の結合による溶媒和自由エネルギーの計算2015
- Author(s)
  神戸宏之、高橋英明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Microscopic Structure of Organic Electrolyte Interface by Molecular Dynamics and Sum Frequency Generation Spectroscopy2015
- Author(s)
  Lin Wang, Qiling Peng, Shen Ye, and Akihiro Morita
- Organizer
  第29回分子シミュレーション討論会
- Place of Presentation
  朱鷺メッセ新潟コンベンションセンター（新潟県新潟市）
- Year and Date
  2015-12-01
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションによる空気／水界面の二次元和周波スペクトル計算2015
- Author(s)
  石山達也、森田明弘
- Organizer
  第29回分子シミュレーション討論会
- Place of Presentation
  朱鷺メッセ新潟コンベンションセンター（新潟県新潟市）
- Year and Date
  2015-12-01
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theory and efficient computation of vibrational difference spectra in water2015
- Author(s)
  Tatsuya Joutsuka and Akihiro Morita
- Organizer
  International Symposium on Soft Molecular Systems
- Place of Presentation
  Tokyo, Japan
- Year and Date
  2015-07-11
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Molecular dynamics simulation study of two-dimensional heterodyne detected sum frequency generation spectra at vapor/water interface2015
- Author(s)
  Tatsuya Ishiyama, Tahei Tahara, and Akihiro Morita
- Organizer
  International Symposium on Soft Molecular Systems
- Place of Presentation
  Tokyo, Japan
- Year and Date
  2015-07-11
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular dynamics simulation study of two-dimensional heterodyne detected sum frequency generation spectra at vapor/water interface2015
- Author(s)
  Tatsuya Ishiyama, Tahei Tahara, and Akihiro Morita
- Organizer
  International Symposium on Soft Molecular Systems
- Place of Presentation
  Tokyo, Japan
- Year and Date
  2015-07-11
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Molecular Dynamics Simulation of Ion transports through Liquid-Liquid Interface2015
- Author(s)
  Nobuaki Kikkawa, Lingjan Wang, Akihiro Morita
- Organizer
  249th ACS National Meeting
- Place of Presentation
  Denver, CO, USA
- Year and Date
  2015-03-25
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical Analysis of Sum Frequency Spectra and Microscopic Ion Transport at Liquid-Liquid Interfaces2015
- Author(s)
  Akihiro Morita
- Organizer
  48th Heyrovsky Discussion on "Progress in Electrochemistry at Liquid-Liquid Interfaces and Liquid Membranes"
- Place of Presentation
  Trest, Czech Republic
- Year and Date
  2015-06-18
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Microscopic Barrier Mechanism of Ion Transport through Liquid-Liquid Interface2015
- Author(s)
  Akihiro Morita
- Organizer
  5th Campus Asia Symposium
- Place of Presentation
  Shanghai, China
- Year and Date
  2015-11-05
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Computational SFG analysis of organic liquid surfaces2015
- Author(s)
  Akihiro Morita, Lin Wang, and Tatsuya Ishiyama
- Organizer
  Pacifichem 2015, Symposium on "Recent Experimental and Theoretical Advances in Studies of Liquid Interfaces"
- Place of Presentation
  Honolulu, HI, USA
- Year and Date
  2015-12-19
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theory and efficient computation of vibrational difference spectra in water, International Symposium on Soft Molecular Systems2015
- Author(s)
  Tatsuya Joutsuka and Akihiro Morita
- Organizer
  International Symposium on Soft Molecular Systems
- Place of Presentation
  Tokyo, Japan
- Year and Date
  2015-07-11
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Analyses of the Solvation Free Energies due to Electron Density Fluctuation using QM/MM Method Combined with a Theory of Solutions2015
- Author(s)
  Daiki Suzuoka, Hideaki Takahashi, and Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2015
- Place of Presentation
  Sendai, Japan
- Year and Date
  2015-08-27
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 溶液中の振動差スペクトルの効率的な計算方法2015
- Author(s)
  城塚達也、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-16
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子動力学シミュレーションによる空気／水界面の二次元和周波スペクトル計算2015
- Author(s)
  石山達也、森田明弘
- Organizer
  第29回分子シミュレーション討論会
- Place of Presentation
  朱鷺メッセ新潟コンベンションセンター（新潟県新潟市）
- Year and Date
  2015-12-01
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Collaborative molecular dynamics and SFG study on the interface of organic carbonate liquids2015
- Author(s)
  Lin Wang, Qiling Peng, Shen Ye, Akihiro Morita
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 溶液界面の分子シミュレーション研究2015
- Author(s)
  森田明弘
- Organizer
  スーパーコンピューターワークショップ2015「様々な対象に応用される計算分子科学」
- Place of Presentation
  自然科学研究機構　岡崎コンファレンスセンター（愛知県・岡崎市）
- Year and Date
  2015-01-30
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子動力学シミュレーションによる生体膜/水界面の構造と振動スペクトル解析2015
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] QM/MM法による溶質分子の電子密度揺らぎにおける軌道間の相関の解析2015
- Author(s)
  鈴岡大樹、高橋英明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面構造の座標化による油水界面のイオン輸送の解析、及び、拡張系の方法を用いた電位差一定のアンサンブルの実現2015
- Author(s)
  吉川信明、Lingjian Wang、森田明弘
- Organizer
  第29回分子シミュレーション討論会
- Place of Presentation
  朱鷺メッセ新潟コンベンションセンター（新潟県新潟市）
- Year and Date
  2015-12-01
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水表面における構造と変角振動スペクトルの分子動力学研究2015
- Author(s)
  田中翔悟、石山達也、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-17
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 第一溶媒和殻をQM領域とするQM/MM法と溶液論の結合による溶媒和自由エネルギーの計算2015
- Author(s)
  神戸宏之、高橋英明、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Vibrational Spectroscopic Study of Lipid/Water Interface by Molecular Dynamics Simulation2015
- Author(s)
  Tatsuya Ishiyama, Daichi Terada, and Akihiro Morita
- Organizer
  Pacifichem 2015, Symposium on "Recent Experimental and Theoretical Advances in Studies of Liquid Interfaces"
- Place of Presentation
  Honolulu, HI, USA
- Year and Date
  2015-12-19
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Microscopic Barrier Mechanism of Ion Transport through Liquid-Liquid Interface2015
- Author(s)
  Akihiro Morita
- Organizer
  5th Campus Asia Symposium
- Place of Presentation
  Shanghai, China
- Year and Date
  2015-10-05
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 不均一反応での理論化学の役割2015
- Author(s)
  森田明弘
- Organizer
  名大太陽研ワークショップ「日本における地球大気化学の将来検討会～不均一反応研究の現状と今後～」
- Place of Presentation
  ホテルKKR（静岡県・熱海市）
- Year and Date
  2015-01-17
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学(MD)シミュレーションによる生体膜/水界面の振動スペクトルと水素結合構造2015
- Author(s)
  寺田大地、石山達也、森田明弘
- Organizer
  第29回分子シミュレーション討論会
- Place of Presentation
  朱鷺メッセ新潟コンベンションセンター（新潟県新潟市）
- Year and Date
  2015-12-01
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 界面構造の座標化による油水界面のイオン輸送の解析2015
- Author(s)
  吉川信明、Lingjian Wang、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-19
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Theoretical analysis on structure and function of solution and polymer interfaces2015
- Author(s)
  Akihiro Morita
- Organizer
  International Symposium on Soft Molecular Systems
- Place of Presentation
  Tokyo, Japan
- Year and Date
  2015-07-09
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波分光解析プログラムCalnosの開発・高速化と水/メタノール混合溶液の気液界面への応用2015
- Author(s)
  石原崇志、石山達也、森田明弘
- Organizer
  第8回6専攻合同シンポジウム
- Place of Presentation
  東北大学青葉山キャンパス（宮城県・仙台市）
- Year and Date
  2015-02-20
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Role of Water Fingering in Ion Transport through Oil-Water Interface2015
- Author(s)
  Nobuaki Kikkawa, Lingjian Wang, and Akihiro Morita
- Organizer
  Pacifichem 2015, Symposium on "Recent Experimental and Theoretical Advances in Studies of Liquid Interfaces"
- Place of Presentation
  Honolulu, HI, USA
- Year and Date
  2015-12-19
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Computational SFG analysis of organic liquid surfaces2015
- Author(s)
  Akihiro Morita, Lin Wang, and Tatsuya Ishiyama
- Organizer
  Pacifichem 2015, Symposium on "Recent Experimental and Theoretical Advances in Studies of Liquid Interfaces"
- Place of Presentation
  Honolulu, HI, USA
- Year and Date
  2015-12-19
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Role of Water Fingering in Ion Transport through Oil-Water Interface2015
- Author(s)
  Nobuaki Kikkawa, Lingjian Wang, and Akihiro Morita
- Organizer
  Pacifichem 2015, Symposium on "Recent Experimental and Theoretical Advances in Studies of Liquid Interfaces"
- Place of Presentation
  Honolulu, HI, USA
- Year and Date
  2015-12-19
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Study of Ion Transport through Liquid Interfaces by using Molecular Dynamics Simulation2015
- Author(s)
  Nobuaki Kikkawa, Lingjian Wang, and Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2015
- Place of Presentation
  Sendai, Japan
- Year and Date
  2015-08-27
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical Analysis of Sum Frequency Spectra and Microscopic Ion Transport at Liquid-Liquid Interfaces2015
- Author(s)
  Akihiro Morita
- Organizer
  48th Heyrovsky Discussion on "Progress in Electrochemistry at Liquid-Liquid Interfaces and Liquid Membranes"
- Place of Presentation
  Trest, Czech Republic
- Year and Date
  2015-06-18
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 界面SFG分光の理論計算2015
- Author(s)
  森田明弘
- Organizer
  東京工業大学資源化学研究所講演会
- Place of Presentation
  東京工業大学資源化学研究所（神奈川県・横浜）
- Year and Date
  2015-01-19
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Dynamics Study of Heterogeneous Kinetics and Reactions2015
- Author(s)
  Akihiro Morita
- Organizer
  International Workshop on Heterogeneous Kinetics Related to Atmospheric Aerosols
- Place of Presentation
  Beijing, China
- Year and Date
  2015-08-10
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Collaborative molecular dynamics and SFG study on the interface of organic carbonate liquids2015
- Author(s)
  Lin Wang, Qiling Peng, Shen Ye, Akihiro Morita
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and efficient computation of vibrational difference spectra2015
- Author(s)
  Tatsuya Joutsuka, Akihiro Morita
- Organizer
  249th ACS National Meeting
- Place of Presentation
  Denver, CO, USA
- Year and Date
  2015-03-25
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical Analysis on the Methods to Derive Surface Molecular Orientation by Sum Frequency Generation Spectroscopy,2015
- Author(s)
  Akihiro Morita, Takashi. Ishihara, Kengo Saito, Tatsuya Ishiyama, Lin Wang
- Organizer
  249th ACS National Meeting
- Place of Presentation
  Denver, CO, USA
- Year and Date
  2015-03-25
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波分光解析プログラムCalnosの開発・高速化と水/メタノール混合溶液の気液界面への応用2015
- Author(s)
  石原崇志、石山達也、森田明弘
- Organizer
  第8回6専攻合同シンポジウム
- Place of Presentation
  東北大学青葉山キャンパス（宮城県・仙台市）
- Year and Date
  2015-02-20
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 不均一反応での理論化学の役割2015
- Author(s)
  森田明弘
- Organizer
  名大太陽研ワークショップ「日本における地球大気化学の将来検討会～不均一反応研究の現状と今後～」
- Place of Presentation
  ホテルKKR（静岡県・熱海市）
- Year and Date
  2015-01-17
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Microscopic Structure of Organic Electrolyte Interface by Molecular Dynamics and Sum Frequency Generation Spectroscopy2015
- Author(s)
  Lin Wang, Qiling Peng, Shen Ye, and Akihiro Morita
- Organizer
  第29回分子シミュレーション討論会
- Place of Presentation
  朱鷺メッセ新潟コンベンションセンター（新潟県新潟市）
- Year and Date
  2015-12-01
- Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 界面構造の座標化による油水界面のイオン輸送の解析2015
- Author(s)
  吉川信明、Lingjian Wang、森田明弘
- Organizer
  第61回ポーラログラフィーおよび電気分析化学討論会
- Place of Presentation
  イーグレひめじ（兵庫県姫路市）
- Year and Date
  2015-11-24
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Recent Computational Studies on Surface Vibrations and Sum Frequency Generation Spectroscopy2015
- Author(s)
  Akihiro Morita
- Organizer
  Carnegie Mellon University
- Place of Presentation
  Pittsburgh, PA, USA
- Year and Date
  2015-03-27
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水/アセトニトリル溶液の界面配向構造と非線形分極の理論研究2015
- Author(s)
  齋藤健吾、森田明弘
- Organizer
  第9回分子科学討論会
- Place of Presentation
  東京工業大学大岡山キャンパス（東京都目黒区）
- Year and Date
  2015-09-18
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 二次元自由エネルギー曲面を用いた液体界面におけるイオン輸送の解析2014
- Author(s)
  吉川信明、王聴鏡、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-23
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 電極界面でのイオン輸送と脱溶媒和過程の分子シミュレーション2014
- Author(s)
  森田明弘
- Organizer
  ESICB電子論検討会
- Place of Presentation
  京都大学工学研究科イノベーションプラザ（京都市・西京区）
- Year and Date
  2014-11-05
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 酢酸の水表面での酸解離平衡の計算2014
- Author(s)
  神戸宏之、高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-23
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水表面の構造と変角振動スペクトルの分子動力学研究（2014
- Author(s)
  田中翔悟、石山達也、森田明弘
- Organizer
  第6回SFG研究会
- Place of Presentation
  筑波大学筑波キャンパス（茨城県・つくば市）
- Year and Date
  2014-08-03
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水表面の構造と変角振動スペクトルの分子動力学研究2014
- Author(s)
  田中翔悟、石山達也、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-13
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 和周波分光解析プログラムCalnosの開発と水/メタノール混合溶液の界面解析への応用2014
- Author(s)
  石原崇志、石山達也、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-13
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 和周波発生界面分光スペクトルに含まれる電気四重極子由来のバルク成分の計算2014
- Author(s)
  澤井寛美、白鳥和矢、石山達也、森田明弘
- Organizer
  第7回6専攻合同シンポジウム
- Place of Presentation
  東北大学青葉山キャンパス（仙台）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 振動差スペクトルの理論と効率的な計算方法2014
- Author(s)
  城塚達也、森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第2回公開シンポジウム
- Place of Presentation
  大阪大学会館・大阪大学豊中キャンパス（大阪府・豊中市）
- Year and Date
  2014-11-28
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] QM/MM-ER法によるATP加水分解の自由エネルギー解析2014
- Author(s)
  高橋英明、三木雄詩、森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第2回公開シンポジウム
- Place of Presentation
  大阪大学会館・大阪大学豊中キャンパス（大阪府・豊中市）
- Year and Date
  2014-11-18
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 振動差スペクトルの理論と効率的な計算方法2014
- Author(s)
  城塚達也、坂口俊、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-13
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波発生界面分光スペクトルに含まれる電気四重極子由来のバルク成分の計算2014
- Author(s)
  澤井寛美、白鳥和矢、石山達也、森田明弘
- Organizer
  第7回6専攻合同シンポジウム
- Place of Presentation
  東北大学青葉山キャンパス（仙台）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 溶液界面の計算分子科学と分光学2014
- Author(s)
  森田明弘
- Organizer
  CMSI/TCCI研究会「分子集合系における先端分析と大規模計算～高度水利用に資するスマート分離技術の基盤構築を目指して～」
- Place of Presentation
  ウィズビジネスセンター（東京）
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 振動差スペクトルの理論と効率的な計算方法2014
- Author(s)
  城塚達也、坂口俊、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-13
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Molecular dynamics analysis of organic solvent interface and nonlinear spectroscopy in relation to batteries2014
- Author(s)
  Lin Wang, Qiling Peng, Shen Ye, Akihiro Morita
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-21
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 酢酸の水表面での酸解離平衡の計算2014
- Author(s)
  神戸宏之、高橋英明、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 液液界面のイオン輸送における微量水の触媒効果2014
- Author(s)
  王聴鏡、吉川信明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-23
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 溶液界面の計算分子科学と分光学2014
- Author(s)
  森田明弘
- Organizer
  CMSI/TCCI研究会「分子集合系における先端分析と大規模計算～高度水利用に資するスマート分離技術の基盤構築を目指して～」
- Place of Presentation
  ウィズビジネスセンター（東京）
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 二次元自由エネルギー曲面を用いた液液界面におけるイオン輸送の解析2014
- Author(s)
  吉川信明、王聴鏡、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Catalytic Effect of Trace Water on Ion Transport through Liquid-Liquid Interface2014
- Author(s)
  Lingjian Wang, Nobuaki Kikkawa, Akihiro Morita
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水表面の構造と変角振動スペクトルの分子動力学研究2014
- Author(s)
  田中翔悟、石山達也、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-22
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 交換ホール関数に基づくQM/MM法における交換反発ポテンシャルの計算2014
- Author(s)
  海野悟、高橋英明、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 電極界面でのイオン輸送と脱溶媒和過程の分子シミュレーション2014
- Author(s)
  森田明弘
- Organizer
  ESICB電子論検討会
- Place of Presentation
  京都大学工学研究科イノベーションプラザ（京都市・西京区）
- Year and Date
  2014-11-05
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Understanding propylene carbonate (PC) interface structure and vibrational spectroscopy using molecule dynamics simulation2014
- Author(s)
  Lin Wang, Akihiro Morita
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子動力学シミュレーションを用いたイオンの液体界面通過に伴う活性化障壁の解析2014
- Author(s)
  吉川信明、森田明弘
- Organizer
  電気化学会第81回大会
- Place of Presentation
  関西大学千里山キャンパス(吹田)
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Becke-Rousselの交換ホール関数によるQM/MM交換反発ポテンシャルの構築2014
- Author(s)
  高橋英明、海野悟、森田明弘
- Organizer
  第17回理論化学討論会
- Place of Presentation
  名古屋大学・東山キャンパス・ES総合館　（愛知県・名古屋市）
- Year and Date
  2014-05-24
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Study of Ion Transport through Liquid Interface by using Molecular Dynamics Simulation2014
- Author(s)
  Nobuaki Kikkawa, Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2014
- Place of Presentation
  Aobayama Campus Tohoku Universities,（Sendai, Japan）
- Year and Date
  2014-09-25
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Structure and Solvation at Aqueous Interfaces2014
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference on Hydrophobocity
- Place of Presentation
  Telluride, CO, USA
- Year and Date
  2014-06-24
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 超並列QM/MM-ER法を用いたATP加水分解反応の自由エネルギー解析2014
- Author(s)
  三木雄詩、高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-22
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 溶液界面の計算分子科学と分光学2014
- Author(s)
  森田明弘
- Organizer
  CMSI/TCCI 研究会「分子集合系における先端分析と大規模計算～高度水利用に資するスマート分離技術の基盤構築を目指して～」
- Place of Presentation
  ウィズビジネスセンター, 東京
- Year and Date
  2014-03-20
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 交換ホール関数に基づくQM/MM法における交換反発ポテンシャルの計算2014
- Author(s)
  海野悟、高橋英明、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Dynamics Simulation of Sum Frequency Generation Spectra at Water and Aqueous Surfaces2014
- Author(s)
  Tatsuya Ishiyama, Akihiro Morita
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  Mita Campus, Keio University （Tokyo, Japan）
- Year and Date
  2014-10-10
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 分子動力学シミュレーションを用いたイオンの液体界面通過に伴う活性化障壁の解析2014
- Author(s)
  吉川信明、森田明弘
- Organizer
  電気化学会第81回大会
- Place of Presentation
  関西大学千里山キャンパス
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Study of Ion Transport through Liquid Interface by using Molecular Dynamics Simulation2014
- Author(s)
  Nobuaki Kikkawa, Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2014
- Place of Presentation
  Aobayama Campus Tohoku Universities,（Sendai, Japan）
- Year and Date
  2014-09-25
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 振動差スペクトルの理論と効率的な計算方法2014
- Author(s)
  坂口俊、城塚達也、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-21
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 二次元自由エネルギー曲面を用いた液体界面におけるイオン輸送の解析2014
- Author(s)
  吉川信明、王聴鏡、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-23
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 和周波分光解析プログラムCalnosを用いた水／メタノール混合溶液の界面解析2014
- Author(s)
  石原崇志、石山達也、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-22
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and Computational Analysis of Surface Nonlinear Spectroscopy2014
- Author(s)
  Akihiro Morita
- Organizer
  10th Triennial Congress of the World Association of Theoretical and Computational Chemists (WATOC 2014)
- Place of Presentation
  Santiago, Chile
- Year and Date
  2014-10-09
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Catalytic Effect of Trace Water on Ion Transport through Liquid-Liquid Interface2014
- Author(s)
  Lingjian Wang, Nobuaki Kikkawa, Akihiro Morita
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 溶液・高分子系界面の構造および機能の理論解析2014
- Author(s)
  森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第2回公開シンポジウム
- Place of Presentation
  大阪大学会館・大阪大学豊中キャンパス（大阪府・豊中市）
- Year and Date
  2014-11-28
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Catalytic Effect of Trace Water on Ion Transport through Liquid-Liquid Interface -- Water Finger Formation and Hydration2014
- Author(s)
  Lingjian Wang, Nobuaki Kikkawa, Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2014
- Place of Presentation
  Aobayama Campus Tohoku Universities,（Sendai, Japan）
- Year and Date
  2014-09-25
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] QM/MM-ER法と摂動論の結合による溶媒和自由エネルギーの計算方法の開発とその評価2014
- Author(s)
  鈴岡大樹、高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-21
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 酢酸の水表面での酸解離平衡の計算2014
- Author(s)
  神戸宏之、高橋英明、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 液液界面のイオン輸送における微量水の触媒効果2014
- Author(s)
  王聴鏡、吉川信明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-23
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水表面の構造と変角振動スペクトルの分子動力学研究2014
- Author(s)
  田中翔悟、石山達也、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-13
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 電解質水溶液表面における分子構造: 和周波発生スペクトルの計算科学的解析2014
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  第65回コロイドおよび界面化学討論会
- Place of Presentation
  東京理科大学神楽坂キャンパス(東京都・新宿区)
- Year and Date
  2014-09-05
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 超並列QM/MM-ER法を用いたATP加水分解反応の自由エネルギー解析2014
- Author(s)
  三木雄詩、高橋英明、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-13
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水表面の構造と変角振動スペクトルの分子動力学研究2014
- Author(s)
  田中翔悟、石山達也、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-22
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 溶液・高分子系界面の構造および機能の理論解析2014
- Author(s)
  森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第2回公開シンポジウム
- Place of Presentation
  大阪大学会館・大阪大学豊中キャンパス（大阪府・豊中市）
- Year and Date
  2014-11-28
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Understanding propylene carbonate (PC) interface structure and vibrational spectroscopy using molecule dynamics simulation2014
- Author(s)
  Lin Wang, Akihiro Morita
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 水資源の高度利用への計算化学の取り組み2014
- Author(s)
  森田明弘
- Organizer
  ポスト京に向けたTCCIインフォーマル研究会
- Place of Presentation
  ウィズビジネスセンター（東京都・中央区）
- Year and Date
  2014-05-21
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子シミュレーションによる液体界面のイオン輸送の解析2014
- Author(s)
  吉川信明、王聴鏡、森田明弘
- Organizer
  第60回ポーラログラフィーおよび電気分析化学討論会
- Place of Presentation
  京都工芸繊維大学 60周年記念館（京都市・左京区）
- Year and Date
  2014-11-16
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波分光解析プログラムCalnosの開発と水/メタノール混合溶液の界面解析への応用2014
- Author(s)
  石原崇志、石山達也、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-13
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Analysis of SFG Spectroscopy of Electrolyte Aqueous Interfaces2014
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride, CO, USA
- Year and Date
  2014-06-12
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] QM/MM-ER法と摂動論の結合によるπ電子の揺らぎの自由エネルギー解析2014
- Author(s)
  鈴岡大樹、高橋英明、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 二次元自由エネルギー曲面を用いた液液界面におけるイオン輸送の解析2014
- Author(s)
  吉川信明、王聴鏡、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 水資源の高度利用への計算化学の取り組み2014
- Author(s)
  森田明弘
- Organizer
  ポスト京に向けたTCCIインフォーマル研究会
- Place of Presentation
  ウィズビジネスセンター（東京都・中央区）
- Year and Date
  2014-05-21
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 超並列QM/MM-ER法を用いたATP加水分解反応の自由エネルギー解析2014
- Author(s)
  三木雄詩、高橋英明、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-13
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 水表面の構造と変角振動スペクトルの分子動力学研究（2014
- Author(s)
  田中翔悟、石山達也、森田明弘
- Organizer
  第6回SFG研究会
- Place of Presentation
  筑波大学筑波キャンパス（茨城県・つくば市）
- Year and Date
  2014-08-03
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波分光解析プログラムCalnosを用いた水／メタノール混合溶液の界面解析2014
- Author(s)
  石原崇志、石山達也、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-22
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 塩基性水溶液表面における和周波分光の理論解析 ― OH-は表面活性か ―2014
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  第6回SFG研究会
- Place of Presentation
  筑波大学筑波キャンパス（茨城県・つくば市）
- Year and Date
  2014-08-02
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] QM/MM-ER法によるATP加水分解の自由エネルギー解析2014
- Author(s)
  高橋英明、三木雄詩、森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第2回公開シンポジウム
- Place of Presentation
  大阪大学会館・大阪大学豊中キャンパス（大阪府・豊中市）
- Year and Date
  2014-11-28
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子シミュレーションによる液体界面のイオン輸送の解析2014
- Author(s)
  吉川信明、王聴鏡、森田明弘
- Organizer
  第60回ポーラログラフィーおよび電気分析化学討論会
- Place of Presentation
  京都工芸繊維大学 60周年記念館（京都市・左京区）
- Year and Date
  2014-11-16
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] エネルギー座標上の電子分布を基本変数とする電子密度交換汎関数の開発2014
- Author(s)
  高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-22
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] QM/MM-ER法と摂動論の結合によるπ電子の揺らぎの自由エネルギー解析2014
- Author(s)
  鈴岡大樹、高橋英明、森田明弘
- Organizer
  第28回分子シミュレーション討論会
- Place of Presentation
  仙台市市民会館（宮城県・仙台市）
- Year and Date
  2014-11-12
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 振動差スペクトルの理論と効率的な計算方法2014
- Author(s)
  坂口俊、城塚達也、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-21
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 交換ホール関数に基づくQM/MM法における交換反発ポテンシャルの計算2014
- Author(s)
  海野悟、高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-23
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and Computational Analysis of Surface Nonlinear Spectroscopy2014
- Author(s)
  Akihiro Morita
- Organizer
  10th Triennial Congress of the World Association of Theoretical and Computational Chemists (WATOC 2014)
- Place of Presentation
  Santiago, Chile
- Year and Date
  2014-10-09
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 電解質水溶液表面における分子構造: 和周波発生スペクトルの計算科学的解析2014
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  第65回コロイドおよび界面化学討論会
- Place of Presentation
  東京理科大学神楽坂キャンパス(東京都・新宿区)
- Year and Date
  2014-09-05
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] エネルギー座標上の電子分布を基本変数とする電子密度交換汎関数の開発2014
- Author(s)
  高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-22
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] QM/MM-ER法と摂動論の結合による溶媒和自由エネルギーの計算方法の開発とその評価2014
- Author(s)
  鈴岡大樹、高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-21
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular dynamics analysis of organic solvent interface and nonlinear spectroscopy in relation to batteries2014
- Author(s)
  Lin Wang, Qiling Peng, Shen Ye, Akihiro Morita
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-21
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 酢酸の水表面での酸解離平衡の計算2014
- Author(s)
  神戸宏之、高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-23
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Becke-Rousselの交換ホール関数によるQM/MM交換反発ポテンシャルの構築2014
- Author(s)
  高橋英明、海野悟、森田明弘
- Organizer
  第17回理論化学討論会
- Place of Presentation
  名古屋大学・東山キャンパス・ES総合館　（愛知県・名古屋市）
- Year and Date
  2014-05-24
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Dynamics Simulation of Sum Frequency Generation Spectra at Water and Aqueous Surfaces2014
- Author(s)
  Tatsuya Ishiyama, Akihiro Morita
- Organizer
  International Symposium on Extended Molecular Dynamics and Enhanced Sampling: Nose Dynamics 30 Years (NOSE30)
- Place of Presentation
  Mita Campus, Keio University （Tokyo, Japan）
- Year and Date
  2014-11-10
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Structure and Solvation at Aqueous Interfaces2014
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference on Hydrophobocity
- Place of Presentation
  Telluride, CO, USA
- Year and Date
  2014-06-24
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Catalytic Effect of Trace Water on Ion Transport through Liquid-Liquid Interface -- Water Finger Formation and Hydration2014
- Author(s)
  Lingjian Wang, Nobuaki Kikkawa, Akihiro Morita
- Organizer
  Tohoku University's Chemistry Summer School 2014
- Place of Presentation
  Aobayama Campus Tohoku Universities,（Sendai, Japan）
- Year and Date
  2014-09-25
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 塩基性水溶液表面における和周波分光の理論解析 ― OH-は表面活性か ―2014
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  第6回SFG研究会
- Place of Presentation
  筑波大学筑波キャンパス（茨城県・つくば市）
- Year and Date
  2014-08-02
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 交換ホール関数に基づくQM/MM法における交換反発ポテンシャルの計算2014
- Author(s)
  海野悟、高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-23
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Analysis of SFG Spectroscopy of Electrolyte Aqueous Interfaces2014
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride, CO, USA
- Year and Date
  2014-06-12
- Invited
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] 超並列QM/MM-ER法を用いたATP加水分解反応の自由エネルギー解析2014
- Author(s)
  三木雄詩、高橋英明、森田明弘
- Organizer
  第8回分子科学討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県・東広島市）
- Year and Date
  2014-09-22
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 振動差スペクトルの理論と効率的な計算方法2014
- Author(s)
  城塚達也、森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第2回公開シンポジウム
- Place of Presentation
  大阪大学会館・大阪大学豊中キャンパス（大阪府・豊中市）
- Year and Date
  2014-11-18
- Data Source
  KAKENHI-PROJECT-26288003
[Presentation] Massively Parallel Implementation of the QM/MM Approach Combined with a Theory of Solutions2013
- Author(s)
  H. Takahashi, Y. Miki and A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center Kobe, Japan
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Development of SFG analyzing software CALNOS and application of surface of methanol/water mixture2013
- Author(s)
  T. Ishihara, T. Ishiyama, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Simulation for Liquid Interfaces2013
- Author(s)
  A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center, Kobe, Japan
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Simulation for Liquid Interfaces2013
- Author(s)
  A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center Kobe, Japan
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Is Water Surface Acidic or Basic?2013
- Author(s)
  A. Morita
- Organizer
  3rd Campus Asia Symposium
- Place of Presentation
  Seoul National University, Seoul, Korea
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 溶液・高分子系界面の構造および機能の理論解析2013
- Author(s)
  森田明弘
- Organizer
  新学術領域「柔らかな分子系」第2回合同合宿会議
- Place of Presentation
  長浜ロイヤルホテル（長浜）
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] The Effect of Ion Pair Formation on Ion Passage through the Liquid-Liquid Interface2013
- Author(s)
  N. Kikkawa and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Molecular Science for Liquid Interfaces2013
- Author(s)
  A. Morita
- Organizer
  5th JCS International Symposium on Theoretical Chemistry
- Place of Presentation
  Todai-ji Temple Comprehensive Cultural Center, Nara, Japan
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Vibrational Spectroscopic Response at Water/Vapor and Ice/Vapor Interfaces : Effect of Charge Transfer2013
- Author(s)
  T. Ishiyama, H. Takahashi, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Study of aqueous NaOH solution surface via computational analysis of sum frequency spectra2013
- Author(s)
  T. Imamura, T. Ishiyama, and A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center Kobe, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 和周波分光解析プログラムCalnosの開発と水／メタノール混合溶液表面への応用2013
- Author(s)
  石原崇志、石山達也、森田明弘
- Organizer
  新学術領域「柔らかな分子系」第2回合同合宿会議
- Place of Presentation
  長浜ロイヤルホテル（長浜）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Free energy analyses for ATP hydrolysis using quantum mechanical /molecular mechanical simulations combined with a theory of solutions2013
- Author(s)
  Y. Miki, H. Takahashi, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and Simulation of Aqueous Interfaces and their Spectroscopy2013
- Author(s)
  A. Morita
- Organizer
  246th ACS National Meeting, Symposium on "Theory and Experiment on Water and Hydration,"
- Place of Presentation
  Indiana Convention Center, Indianapolis,　IN
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 電気四重極由来のバルク成分を含めた和周波発生界面分光法の包括的な計算2013
- Author(s)
  澤井寛美、白鳥和矢、石山達也、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Why is benzene soluble in water? -Role of the fluctuation of π electrons in aromatic solutes immersed in water. -2013
- Author(s)
  D. Suzuoka, S. Kimura, H. Takahashi, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Study of aqueous NaOH solution surface via computational analysis of sum frequency spectra2013
- Author(s)
  T. Imamura, T. Ishiyama, and A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center, Kobe, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Analysis of ion transport by using 2D free energy profile2013
- Author(s)
  N. Kikkawa and A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center, Kobe, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 柔らかな界面の構造と機能の理論解析2013
- Author(s)
  森田明弘
- Organizer
  日本化学会第93春季年会シンポジウム「複雑系のための分子科学‐複雑さと柔らかさ」
- Place of Presentation
  草津
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Free energy analyses for ATP hydrolysis using quantum mechanical/molecular mechanical simulations combied with a theory of solutions2013
- Author(s)
  Y. Miki, H. Takahashi, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2013
- Place of Presentation
  Aobayama Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and Simulation of Aqueous Interfaces and their Spectroscopy2013
- Author(s)
  A. Morita
- Organizer
  246th ACS National Meeting, Symposium on "Theory and Experiment on Water and Hydration,"
- Place of Presentation
  Indiana Convention Center, Indianapolis, IN
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical analysis of ion transport through soft interfaces2013
- Author(s)
  N. Kikkawa, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2013
- Place of Presentation
  Aobayama Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Analysis of ion transport by using 2D free energy profile2013
- Author(s)
  N. Kikkawa and A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center Kobe, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水溶液表面における酸性度の理論計算2013
- Author(s)
  田部裕輔、吉川信明、高橋英明、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 溶液・高分子系界面の構造および機能の理論解析2013
- Author(s)
  森田明弘
- Organizer
  新学術領域研究「柔らかな分子系」第1回公開シンポジウム
- Place of Presentation
  東京工業大学町田キャンパス (東京)
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and Computational Analysis of Sum Frequency Generation Spectroscopy of Liquid Interfaces2013
- Author(s)
  A. Morita
- Organizer
  CECAM Workshop "Liquid/Solid Interfaces: Structure and Dynamics from Spectroscopy and Simulations,"
- Place of Presentation
  CECAM-HQ-EPFL, Lausanne, Switzerland
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Development of software "CALNOS" for nonlinear spectroscopy calculation and its application to surface of water/methanol mixture2013
- Author(s)
  T. Ishihara, T. Ishiyama, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2013
- Place of Presentation
  Aobayama Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computation of the solvation free energies due to the fluctuation of π-electrons in benzene in water utilizing the QM/MM simulations combined with perturbation theory2013
- Author(s)
  D. Suzuoka, S. Kimura, H. Takahashi, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2013
- Place of Presentation
  Aobayama Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水和におけるπ電子の揺らぎの自由エネルギー解析2013
- Author(s)
  鈴岡大樹、高橋英明、木村慎太郎、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theory and Computational Analysis of Sum Frequency Generation Spectroscopy of Liquid Interfaces2013
- Author(s)
  A. Morita
- Organizer
  CECAM Workshop "Liquid/Solid Interfaces : Structure and Dynamics from Spectroscopy and Simulations," CECAM-HQ-EPFL
- Place of Presentation
  Lausanne, Switzerland
- Year and Date
  2013-06-24
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Elucidation of surface acidity of trimethylamine water solution by computational method2013
- Author(s)
  Y. Tabe, N. Kikkawa, H. Takahashi, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Science for Liquid Interfaces2013
- Author(s)
  A. Morita
- Organizer
  5th JCS International Symposium on Theoretical Chemistry, Todai-ji Temple Comprehensive Cultural Center
- Place of Presentation
  Nara, Japan
- Year and Date
  2013-12-03
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Theory and Simulation of Aqueous Interfaces and their Spectroscopy2013
- Author(s)
  A. Morita
- Organizer
  246th ACS National Meeting, Symposium on "Theory and Experiment on Water and Hydration," Indianapolis
- Place of Presentation
  Indiana Convention, Center, Indianapolis
- Year and Date
  2013-09-09
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 硫酸エアロゾル表面における取り込み反応への有機化合物の影響2013
- Author(s)
  坂口俊、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Development of software "CALNOS" for nonlinear spectroscopy calculation and its application to surface of water/methanol mixture2013
- Author(s)
  T. Ishihara, T. Ishiyama, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2013
- Place of Presentation
  Aobayama Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Free energy calculations for chemical reactions in condensed phase with massively parallel QM/MM simulations2013
- Author(s)
  H. Takahashi, Y. Miki and A. Morita
- Organizer
  5th JCS International Symposium on Theoretical Chemistry
- Place of Presentation
  Todai-ji Temple Comprehensive Cultural Center, Nara, Japan
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Free energy analyses for ATP hydrolysis using quantum mechanical/molecular mechanical simulations combied with a theory of solutions2013
- Author(s)
  Y. Miki, H. Takahashi, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2013
- Place of Presentation
  Aobayama Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Vibrational Spectroscopic Response at Water/Vapor and Ice/Vapor Interfaces : Effect of Charge Transfer2013
- Author(s)
  T. Ishiyama, H. Takahashi, and A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center Kobe, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 柔らかな界面の構造と機能の理論解析、シンポジウム「複雑系のための分子科学‐複雑さと柔らかさ」2013
- Author(s)
  森田明弘
- Organizer
  日本化学会第93春季年会
- Place of Presentation
  フォレストハウス, 草津
- Year and Date
  2013-03-22
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 電気四重極由来のバルク成分を含めた和周波発生界面分光法の包括的な計算2013
- Author(s)
  澤井寛美、白鳥和矢、石山達也、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 水，水溶液界面での構造と振動スペクトルの分子動力学シミュレーション2013
- Author(s)
  石山達也、森田明弘
- Organizer
  新学術領域「柔らかな分子系」第2回合同合宿会議
- Place of Presentation
  長浜ロイヤルホテル（長浜）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Comprehensive calculation of sum frequency generation spectroscopy including the bulk contribution from electric quadrupole2013
- Author(s)
  H. Sawai, K. Shiratori, T. Ishiyama, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分子シミュレーションによる溶液界面化学の新展開2013
- Author(s)
  森田明弘
- Organizer
  分子研シンポジウム2013
- Place of Presentation
  分子科学研究所, 岡崎
- Year and Date
  2013-05-31
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Molecular Simulation for Liquid Interfaces2013
- Author(s)
  A. Morita
- Organizer
  3rd International Conference on Molecular Simulation, Kobe International Conference Center
- Place of Presentation
  Kobe, Japan
- Year and Date
  2013-11-18
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Why is benzene soluble in water? -Role of the fluctuation of π electrons in aromatic solutes immersed in water. -2013
- Author(s)
  D. Suzuoka, S. Kimura, H. Takahashi, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水溶液表面における酸性度の理論計算2013
- Author(s)
  田部裕輔、吉川信明、高橋英明、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] The Effect of Ion Pair Formation on Ion Passage through the Liquid-Liquid Interface2013
- Author(s)
  N. Kikkawa and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 水，氷の表面構造と和周波スペクトルの分子動力学計算：電荷移動の効果について2013
- Author(s)
  石山達也、高橋英明、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 分子シミュレーションによる溶液界面化学の新展開2013
- Author(s)
  森田明弘
- Organizer
  分子研シンポジウム2013
- Place of Presentation
  分子科学研究所(岡崎)
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 実空間グリッドによる電子密度汎関数法の超並列化とその評価2013
- Author(s)
  高橋英明、三木雄詩、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Molecular Science for Liquid Interfaces2013
- Author(s)
  A. Morita
- Organizer
  5th JCS International Symposium on Theoretical Chemistry
- Place of Presentation
  Todai-ji Temple Comprehensive Cultural Center,Nara, Japan
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 和周波分光解析プログラムCalnosの開発と水/メタノール混合溶液表面への応用2013
- Author(s)
  原崇志、石山達也、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computation of the solvation free energies due to the fluctuation of π-electrons in benzene in water utilizing the QM/MM simulations combined with perturbation theory2013
- Author(s)
  D. Suzuoka, S. Kimura, H. Takahashi, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2013
- Place of Presentation
  Aobayama campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Vibrational Spectroscopic Response at Water/Vapor and Ice/Vapor Interfaces : Effect of Charge Transfer2013
- Author(s)
  T. Ishiyama, H. Takahashi, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Is Water Surface Acidic or Basic?2013
- Author(s)
  A. Morita
- Organizer
  3rd Campus Asia Symposium
- Place of Presentation
  Seoul National University, Seoul, Korea
- Invited
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Free energy analyses for ATP hydrolysis using quantum mechanical /molecular mechanical simulations combined with a theory of solutions2013
- Author(s)
  Y. Miki, H. Takahashi, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水，氷の表面構造と和周波スペクトルの分子動力学計算：電荷移動の効果について2013
- Author(s)
  石山達也、高橋英明、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Molecular dynamics study of water transfer at supercooled sulfuric acid solution surface covered with butanol2013
- Author(s)
  S. Sakaguchi and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Molecular dynamics study of water transfer at supercooled sulfuric acid solution surface covered with butanol2013
- Author(s)
  S. Sakaguchi and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Theoretical analysis of ion transport through soft interfaces2013
- Author(s)
  N. Kikkawa, A. Morita
- Organizer
  Tohoku University's Chemistry Summer School 2013
- Place of Presentation
  Aobayama Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 実空間グリッドによる電子密度汎関数法の超並列化とその評価2013
- Author(s)
  高橋英明、三木雄詩、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Free energy calculations for chemical reactions in condensed phase with massively parallel QM/MM simulations2013
- Author(s)
  H. Takahashi, Y. Miki and A. Morita
- Organizer
  5th JCS International Symposium on Theoretical Chemistry
- Place of Presentation
  Todai-ji Temple Comprehensive Cultural Center,Nara, Japan
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Elucidation of surface acidity of trimethylamine water solution by computational method2013
- Author(s)
  Y. Tabe, N. Kikkawa, H. Takahashi, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Development of SFG analyzing software CALNOS and application of surface of methanol/water mixture2013
- Author(s)
  T. Ishihara, T. Ishiyama, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] イオン輸送に伴う液体界面の構造変化の役割2013
- Author(s)
  吉川信明、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Massively Parallel Implementation of the QM/MM Approach Combined with a Theory of Solutions2013
- Author(s)
  H. Takahashi, Y. Miki and A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center, Kobe, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] イオン輸送に伴う液体界面の構造変化の役割2013
- Author(s)
  吉川信明、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] QM/MM-ER法によるATPモデル分子の加水分解自由エネルギーの計算2013
- Author(s)
  三木雄詩、高橋英明、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 硫酸エアロゾル表面における取り込み反応への有機化合物の影響2013
- Author(s)
  坂口俊、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水和におけるπ電子の揺らぎの自由エネルギー解析2013
- Author(s)
  鈴岡大樹、高橋英明、木村慎太郎、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] QM/MM-ER法によるATPモデル分子の加水分解自由エネルギーの計算2013
- Author(s)
  三木雄詩、高橋英明、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Vibrational Spectroscopic Response at Water/Vapor and Ice/Vapor Interfaces : Effect of Charge Transfer2013
- Author(s)
  T. Ishiyama, H. Takahashi, and A. Morita
- Organizer
  3rd International Conference on Molecular Simulation
- Place of Presentation
  Kobe International Conference Center, Kobe, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] Comprehensive calculation of sum frequency generation spectroscopy including the bulk contribution from electric quadrupole2013
- Author(s)
  H. Sawai, K. Shiratori, T. Ishiyama, and A. Morita
- Organizer
  International Symposium for the 70th Anniversary of the Tohoku Branch of the Chemical Society of Japan
- Place of Presentation
  Kawauchi Campus Tohoku University, Sendai, Japan
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 和周波分光解析プログラムCalnosの開発と水/メタノール混合溶液表面への応用2013
- Author(s)
  石原崇志、石山達也、森田明弘
- Organizer
  第7回分子科学討論会
- Place of Presentation
  京都テルサ（京都）
- Data Source
  KAKENHI-PLANNED-25104003
[Presentation] 二次の非線形界面分光における電気四極子由来のバルク成分の計算2012
- Author(s)
  澤井寛美、白鳥和矢、石山達也、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 単分子膜に覆われた液体界面における取り込み確率：分子動力学とLangevin 動力学を用いた計算2012
- Author(s)
  坂口俊、森田明弘
- Organizer
  第15回理論化学討論会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] イオン輸送における界面揺らぎの影響の解析2012
- Author(s)
  吉川信明、森田明弘
- Organizer
  第26回分子シミュレーション討論会
- Place of Presentation
  福岡
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] QM/MM法と溶液論によるATPモデル分子の加水分解反応の自由エネルギー解析2012
- Author(s)
  高橋英明、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computational analysis of sum frequency generation spectroscopy2012
- Author(s)
  Akihiro Morita
- Organizer
  University of Akron
- Place of Presentation
  Akron, OH, USA,
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 単分子膜透過現象のシミュレーションによる評価：分子動力学とLangevin 動力学による解析2012
- Author(s)
  坂口俊、森田明弘
- Organizer
  平成24年度化学系学協会東北大会
- Place of Presentation
  秋田
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 振動スペクトルからみえる水/疎水性液体界面の構造2012
- Author(s)
  石山達也、佐藤祐史、森田明弘
- Organizer
  第26回分子シミュレーション討論会
- Place of Presentation
  福岡
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Hofmeister series の中に見る電解質水溶液表面の分子構造へのイオンの効果2012
- Author(s)
  今村貴子、水越祐里、石山達也、森田明弘
- Organizer
  平成24年度化学系学協会東北大会
- Place of Presentation
  秋田
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 相間移動触媒のイオン輸送と界面の微視的構造および電気二重層形成の効果2012
- Author(s)
  吉川信明、石山達也、森田明弘
- Organizer
  第15回理論化学討論会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面和周波分光の理論と解析手法の新展開2012
- Author(s)
  森田明弘
- Organizer
  日本表面科学会学術講演会「電極表面科学の深化と進化を目指す計測と理論の新展開」
- Place of Presentation
  仙台
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Unified view of χ^(2) of liquid water studied by MD and SFG spectroscopy2012
- Author(s)
  A. Morita
- Organizer
  ACS National Meeting, Symposium on "Atmospheric and Geochemical Interfaces"
- Place of Presentation
  San Diego, Convention Center, San Diego, CA, USA
- Year and Date
  2012-03-25
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水/疎水性液体界面の構造と振動スペクトルの多様性:分子動力学計算から得られる知見2012
- Author(s)
  石山達也、佐藤祐史、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Mechanisms of Sum Frequency Generation from Liquid Benzene: Symmetry Breaking at Interface and Bulk Contribution2012
- Author(s)
  Akihiro Morita
- Organizer
  ACS National Meeting, Symposium on "Recent Advances in Studies of Molecular Processes at Liquid Interfaces"
- Place of Presentation
  Phidaldephia, PA, USA
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computational analysis of SFG spectroscopy and application to liquid interfaces2012
- Author(s)
  A. Morita
- Organizer
  Pacific Northwest National Laboratory
- Place of Presentation
  Richland, WA, USA
- Year and Date
  2012-06-22
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Mechanisms of Sum Frequency Generation from Liquid Benzene : Symmetry Breaking at Interface and Bulk Contribution2012
- Author(s)
  A. Morita
- Organizer
  ACS National Meeting, Symposium on "Recent Advances in Studies of Molecular Processes at Liquid Interfaces", Phidaldephia Conbention Center, Phidaldephia
- Place of Presentation
  PA, USA
- Year and Date
  2012-08-20
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面非線形分光の実験と計算化学による溶液界面研究の進展2012
- Author(s)
  森田明弘
- Organizer
  第25期CAMMフォーラム本例会
- Place of Presentation
  参道「アイビーホール」, 東京
- Year and Date
  2012-02-03
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] トリメチルアミン水溶液の表面酸性度の計算2012
- Author(s)
  田部裕輔、高橋英明、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分子動力学とLangevin動力学の両立による単分子膜における分子の膜透過現象の解析2012
- Author(s)
  坂口俊、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分極モデルを用いる分子動力学法と溶液理論の結合による溶媒和自由エネルギーの計算2012
- Author(s)
  鈴岡大樹、高橋英明、石山達也、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Analysis of SFG Spectra of Organic Liquid Surfaces2012
- Author(s)
  Akihiro Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride, CO, USA
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分子動力学シミュレーションとPoisson-Boltzmann方程式の組み合わせによる液液界面近傍のイオン輸送現象の解析2012
- Author(s)
  吉川信明、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面和周波分光の理論と解析手法の新展開2012
- Author(s)
  森田明弘
- Organizer
  日本表面科学会学術講演会「電極表面科学の深化と進化を目指す計測と理論の新展開」
- Place of Presentation
  東北大学片平キャンパスさくらホール, 仙台
- Year and Date
  2012-11-22
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] QM/MM 法に基づく溶質の電子密度の揺らぎによる溶媒和自由エネルギーの新規な計算法の開発とその応用2012
- Author(s)
  高橋英明、近江惇、森田明弘
- Organizer
  第15回理論化学討論会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水表面構造に対するイオンの多様な効果―界面和周波分光の計算化学的解析―2012
- Author(s)
  今村貴子、水越祐里、石山達也、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分極モデルと溶液理論による溶媒和自由エネルギー計算の方法論の開発とその応用2012
- Author(s)
  鈴岡大樹、高橋英明、石山達也、森田明弘
- Organizer
  第15回理論化学討論会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面非線形分光の解析計算ソフトCalnosの開発2012
- Author(s)
  森田明弘
- Organizer
  第2回ナノ統合ソフトウェア説明会
- Place of Presentation
  東京
- Year and Date
  2012-01-26
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] SFG and MD simulation study of surface structure of aqueous sulfuric acid solution2012
- Author(s)
  Takayuki Miyamae, Tatsuya Ishiyama, and Akihiro Morita
- Organizer
  14th International Conference on Vibrations at Surfaces
- Place of Presentation
  Kobe, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Water and Ice Surfaces studied by Combination of Nonlinear Spectroscopy and Molecular Dynamics Simulation2012
- Author(s)
  Akihiro Morita
- Organizer
  Campus Asia Sendai Symposium
- Place of Presentation
  Sendai, Japan
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 赤外-可視和周波発生分光法を用いたイオン液体[Cnmim][OTf] + H2O混合系の表面構造の研究2012
- Author(s)
  酒井康成、Kamalakanta Behera、岩橋崇、石山達也、森田明弘、Kim Doseok、大内幸雄
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Unified view of surface nonlinear susceptibility chi(2) of liquid water studied by molecular dynamics and sum frequency generation spectroscopy2012
- Author(s)
  A.Morita
- Organizer
  TBA, ACS National Meeting, Symposium on "Atmospheric and Geochemical Interfaces"
- Place of Presentation
  San Diego, CA, USA
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分極モデルとエネルギー表示の理論による溶媒和自由エネルギー計算の方法論の開発2012
- Author(s)
  鈴岡大樹、高橋英明、石山達也、森田明弘
- Organizer
  第26回分子シミュレーション討論会
- Place of Presentation
  福岡
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水及び液体Ar中における微小気泡内圧の解明2012
- Author(s)
  高橋秀明、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computational analysis of sum frequency generation spectroscopy2012
- Author(s)
  A. Morita
- Organizer
  University of Akron, Akron
- Place of Presentation
  OH, USA
- Year and Date
  2012-08-24
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] QM/MM-ER 法によるATP モデル分子の加水分解反応の自由エネルギー解析2012
- Author(s)
  高橋英明、三木雄詩、近江惇、森田明弘
- Organizer
  第26回分子シミュレーション討論会
- Place of Presentation
  福岡
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面和周波発生分光の理論の開発と液体界面への応用2012
- Author(s)
  森田明弘
- Organizer
  平成24年度化学系学協会東北大会
- Place of Presentation
  秋田大学手形キャンパス
- Year and Date
  2012-09-15
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面非線形分光の実験と計算化学による溶液界面研究の進展2012
- Author(s)
  森田明弘
- Organizer
  第25期CAMMフォーラム本例会
- Place of Presentation
  東京
- Year and Date
  2012-02-03
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Analysis of SFG Spectra of Organic Liquid Surfaces2012
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride Intermediate School, Telluride, CO, USA
- Year and Date
  2012-06-20
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 和周波実験と理論計算の連携による界面の分子科学2012
- Author(s)
  森田明弘
- Organizer
  第5回SFG研究会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 表面分光による配向解析とは何か？ - 分子シミュレーションによる検討2012
- Author(s)
  武井祐介、石山達也、森田明弘
- Organizer
  第6回分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面和周波発生分光の理論の開発と液体界面への応用2012
- Author(s)
  森田明弘
- Organizer
  平成24年度化学系学協会東北大会
- Place of Presentation
  秋田
- Invited
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] イオン輸送における相間移動触媒の役割についての理論的研究2012
- Author(s)
  吉川信明、森田明弘
- Organizer
  平成24年度化学系学協会東北大会
- Place of Presentation
  秋田
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面分光の理論と実験-協力体制が拓く界面化学2011
- Author(s)
  森田明弘
- Organizer
  第91回日本化学会春季年会「先端ウオッチング : 高次実在分子システムのための分子科学:実験と理論による機能発現の分子論的理解」
- Place of Presentation
  神奈川大学横浜キャンパス, 横浜
- Year and Date
  2011-03-27
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Ne-Ar混合系における衝突誘起吸収スペクトルの動力学的計算2011
- Author(s)
  山崎達人, 森田明弘, 菅野学, 河野裕彦
- Organizer
  第91回日本化学会春季年会
- Place of Presentation
  横浜
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水表面での分子内・分子間振動カップリングのSFGスペクトルへの影響2011
- Author(s)
  李徳冠、石山達也、二本柳聡、山口祥一、田原太平、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 微小気泡内圧のサイズ依存性に関する分子動力学シミュレーション2011
- Author(s)
  高橋秀明、森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 溶液界面での分子の振る舞いを捉える2011
- Author(s)
  森田明弘
- Organizer
  2011年物理化学合同川渡セミナー
- Place of Presentation
  仙台
- Year and Date
  2011-06-17
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面分光の理論と実験-協力体制が拓く界面化学2011
- Author(s)
  森田明弘
- Organizer
  分子研研究会「実験と理論による高次分子システムの機能発現の分子論的理解」
- Place of Presentation
  分子科学研究所, 岡崎
- Year and Date
  2011-11-01
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] アセトニトリル水溶液の和周波発生分光法による配向解析手法の理論2011
- Author(s)
  武井祐介、石山達也、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 電極界面の溶液構造と物質移動2011
- Author(s)
  森田明弘
- Organizer
  触媒・電池研究会
- Place of Presentation
  京都
- Year and Date
  2011-12-27
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 相間移動触媒によるイオン輸送の分子動力学シミュレーション2011
- Author(s)
  吉川信明、石山達也、森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Theory and Computation of Sum Frequency Generation Spectroscopy2011
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on Chemistry and Dynamics in Complex Environments
- Place of Presentation
  Telluride Intermadiate School, Telluride, CO, USA
- Year and Date
  2011-06-30
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Theory of sum frequency generation spectroscopy and application to liquid surfaces2011
- Author(s)
  A. Morita
- Organizer
  CECAM Workshop on Vibrational Spectroscopy of Complex Systems, Ecole Normale Suprieure - Chemistry Department
- Place of Presentation
  Paris, France
- Year and Date
  2011-05-25
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 振動和周波スペクトルからみえる水表面の水素結合構造2011
- Author(s)
  石山達也, 李徳冠, 二本柳聡史, 山口祥一, 田原太平, 森田明弘
- Organizer
  第25回分子シミュレーション討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 和周波振動分光と分子動力学計算を用いた水/イオン液体界面構造の研究2011
- Author(s)
  岩橋崇、酒井康成、Kim Doseok、石山達也、森田明弘、大内幸雄
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computer Simulation of Surface Nonlinear Spectroscopy2011
- Author(s)
  A. Morita, T. Ishiyama and K. Shiratori
- Organizer
  International Conference on Computational Science 2011, "Large Scale Computational Molecular Science"
- Place of Presentation
  Nanyang Executive Centre, Singapore
- Year and Date
  2011-06-02
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 液体界面での計算分子科学の新展開2011
- Author(s)
  森田明弘
- Organizer
  多元研ミニシンポジウム「第一原理計算化学の最前線」
- Place of Presentation
  仙台
- Year and Date
  2011-09-30
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] なぜ液体ベンゼンの界面で和周波発生が起こったか2011
- Author(s)
  川口達也、石山達也、森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 固液界面近傍でのイオン水和殻の振動分光と吸着ダイナミクスの解明2011
- Author(s)
  添田英司、石山達也、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面分光の理論と実験-協力体制が拓く界面化学2011
- Author(s)
  森田明弘
- Organizer
  第91回日本化学会春季年会「先端ウオッチング:高次実在分子システムのための分子科学:実験と理論による機能発現の分子論的理解」
- Place of Presentation
  横浜
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Electric quadrupole contribution to the nonresonant background of sum frequency generation at air/liquid interfaces2011
- Author(s)
  S.Yamaguchi, K.Shiratori, A.Morita, T.Tahara
- Organizer
  第27回化学反応討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] QM/MM-ER法による多体相互作用に伴う自由エネルギー変化の厳密な取り扱い2011
- Author(s)
  高橋英明、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水の気液界面におけるプロトンの水租の自由エネルギー解析2011
- Author(s)
  高橋英明, 森田明弘
- Organizer
  次世代スーパーコンピュータブロジェクトナノ統合拠点、第5回公開シンポジウム
- Place of Presentation
  神戸
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 液体界面での計算分子科学の新展開2011
- Author(s)
  森田明弘
- Organizer
  多元研ミニシンポジウム「第一原理計算化学の最前線」
- Place of Presentation
  東北大学片平キャンパス, 仙台
- Year and Date
  2011-09-30
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 液体界面の局所電場理論と分子シミュレーション2011
- Author(s)
  白鳥和矢、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 電極界面近傍におけるイオン水和殻の分子動力学シミュレーション2011
- Author(s)
  添田英司、石山達也、森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Theory and Computation of Surface Nonlinear Spectroscopy and Structure of Water Surface2011
- Author(s)
  A.Morita
- Organizer
  14th Korea-Japan Joint Symposium on Frontiers of Molecular Science "New Visions for Spectroscopy and Computation : Temporal and Spatial Adventures of Molecular Sciences"
- Place of Presentation
  Busan, Korea
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Na_2SO_4水溶液の界面構造-埋もれたイオンの及ぼす大きな影響-2011
- Author(s)
  水越祐里、今村貴子、石山達也、森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 液体メタノールのC-H伸縮振動領域に対する赤外吸収,ラマン,和周波発生スペクトルの統一的理解2011
- Author(s)
  石山達也、Sokolov Vladimir、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 電極界面でのイオン輸送と脱溶媒和過程の分子シミュレーション2011
- Author(s)
  森田明弘
- Organizer
  計算物質科学イニシアティブ元素戦略ワークショップ電池
- Place of Presentation
  東京
- Year and Date
  2011-11-09
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面分光の理論と実験-協力体制が拓く界面化学2011
- Author(s)
  森田明弘
- Organizer
  子研研究会「実験と理論による高次分子システムの機能発現の分子論的理解」
- Place of Presentation
  岡崎
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 赤外-可視和周波発生分光法を用いたアルカン/イオン液体界面構造の研究2011
- Author(s)
  酒井康成、岩橋崇、小川よしみ、石山達也、森田明弘、Kim Doseok、大内幸雄
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 自由エネルギー計算を用いた相間移動触媒の分子機構の解析2011
- Author(s)
  吉川信明、石山達也、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] アセトニトリル-水混合溶液の界面構造2011
- Author(s)
  武井祐介, 石山達也, 森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computer Simulation of Surface Nonlinear Spectroscopy, International Conference on Computational Science 20112011
- Author(s)
  A.Morita, T.Ishiyama, K.Shiratori
- Organizer
  Large Scale Computational Molecular Science
- Place of Presentation
  Singapore
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Theory and Computation of Surface Nonlinear Spectroscopy and Structure of Water Surface2011
- Author(s)
  A. Morita
- Organizer
  14th Korea-Japan Joint Symposium on Frontiers of Molecular Science "New Visions for Spectroscopy and Computation : Temporal and Spatial Adventures of Molecular Sciences"
- Place of Presentation
  Haeundae Grand_HotelBusan, Korea
- Year and Date
  2011-07-06
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面分光実験と分子シミュレーションの共同研究による水表面構造の解明2011
- Author(s)
  森田明弘
- Organizer
  第6回高次系分子科学合同班会議
- Place of Presentation
  沖縄
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 有機分子界面での和周波発生振動分光の理論2011
- Author(s)
  石山達也, Vladimir V.Sokolov, 森田明弘
- Organizer
  次世代スーパーコンピュータプロジェクトナノ統含拠点、第5回公開シンポジウム
- Place of Presentation
  神戸
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] NaF、NaOH水溶液の表面構造と和周波スペクトルの計算化学的解析2011
- Author(s)
  高橋秀明、森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 液体ベンゼン界面の和周波発生における対称性の破れのメカニズム2011
- Author(s)
  川口達也、石山達也、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分子動力学シミュレーションを用いた微小気泡内圧の解明2011
- Author(s)
  高橋秀明、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Electric quadrupole contribution to the nonresonant background of sum frequency generation at air/liquid interfaces2011
- Author(s)
  山口祥一、白鳥和矢、森田明弘、田原太平
- Organizer
  第27回化学反応討論会
- Place of Presentation
  東京工業大学大岡山キャンパス(東京都)
- Data Source
  KAKENHI-PLANNED-19056009
[Presentation] Theory of sum frequency generation spectroscopy and application to liquid surfaces, CECAM Workshop on Vibrational Spectroscopy of Complex Systems2011
- Author(s)
  A.Morita
- Organizer
  CECAM Workshop on Vibrational Spectroscopy of Complex Systems
- Place of Presentation
  Paris, Prance
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 同位体希釈による水表面のSFGスペクトルの変化の解析2011
- Author(s)
  李徳冠、石山達也、二本柳聡、山口祥一、田原太平、森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 空気/水界面での水分子の構造と振動分光の分子動力学計算2011
- Author(s)
  石山達也, 森田明弘
- Organizer
  次世代スーパーコンピュータプロジェクトナノ統合拠点、第5回公開シンポジウム
- Place of Presentation
  神戸
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 電解質水溶液の表面構造と和周波スペクトルへの埋もれたアニオンの効果2011
- Author(s)
  今村貴子、水越祐里、石山達也、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水分子の蒸発・取り込みに対する表面活性分子の影響2011
- Author(s)
  坂口俊、森田明弘
- Organizer
  平成23年度化学系学協会東北大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] アルコール単分子膜に覆われた気液界面における物質輸送のダイナミクス2011
- Author(s)
  坂口俊、森田明弘
- Organizer
  第5回分子科学討論会
- Place of Presentation
  札幌
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 硫酸水溶液表面の解離状態-理論と実験の双方向アプローチー2011
- Author(s)
  宮前孝行、石山達也、森田明弘
- Organizer
  表面・界面スペクトロスコピー2011
- Place of Presentation
  三浦
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Theoretical Analysis on the Phase of Nonlinear Susceptibility at Water Surface2010
- Author(s)
  A.Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride, CO.USA.
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] メチル基の分子モデリングの開発と振動分光のMDシミュレーション2010
- Author(s)
  石山達也, VladimirV.Sokolov, 森田明弘
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Development of Theory on Surface Nonlinear Spectroscopy and Application to Liquid Interfaces2010
- Author(s)
  A. Morita
- Organizer
  International Symposium on Molecular Theory for Real Systems
- Place of Presentation
  京都大学福井謙一記念研究センター Kyoto, Japan
- Year and Date
  2010-01-07
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 希ガスの衝突誘起吸収スペクトルのMDシミュレーション2010
- Author(s)
  由崎達人, 森田明弘, 河野裕彦
- Organizer
  平成22年度化学系学協会東北大会
- Place of Presentation
  盛岡
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Development of Theory on Surface Nonlinear Spectroscopy and Application to Liquid Interfaces2010
- Author(s)
  森田明弘
- Organizer
  International Symposium on Molecular Theory for Real Systems
- Place of Presentation
  Kyoto, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Becke-Roussel型の交換汎関数のG3分子セットへの応用と交換ホール関数の解析2010
- Author(s)
  高橋英明, 中野雅由, 森田明弘
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computation of reaction free energies by the QM/MM-ER approach-Exact treatment of the many-body interactions-2010
- Author(s)
  H.Takahashi, A.Morita
- Organizer
  7th Congress of the International Society for Theoretical Chemical Physics
- Place of Presentation
  Tokyo, Japan
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面非線形分光の分子シミュレーション計算手法の開発2010
- Author(s)
  森田明弘
- Organizer
  スーパーコンピューターワークショップ2010
- Place of Presentation
  岡崎
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Computational analysis of nonlinear spectroscopy at water surface2010
- Author(s)
  A. Morita and T. Ishiyama
- Organizer
  Pacifichem 2010, Symposium "Molecular Dynamics in Complex Environments : Theory and Experiments"
- Place of Presentation
  Sheraton Waikiki, Honolulu, Hawaii, USA
- Year and Date
  2010-12-18
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] QM/MM-ER法による水の気液界面におけるプロトンの水和の自由エネルギー解析2010
- Author(s)
  高橋英明, 丸山邦彦, 中野雅由, 森田明弘
- Organizer
  第24回分子シミュレーション討論会
- Place of Presentation
  福井
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 電極近傍における疎水性カチオン周りの水和構造解析2010
- Author(s)
  添田英司, 石山達也, 森田明弘
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 和周波振動分光と分子動力学計算を用いたアルコール/イオン液体界面構造の研究2010
- Author(s)
  岩橋崇, 酒井康成, Kim Doseok, 石山達也, 森田明弘, 大内幸雄
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] NaOH水溶液表面構造への水酸化物イオンの影響2010
- Author(s)
  今村貴子, 石山達也, 森田明弘
- Organizer
  平成22年度化学系学協会東北大会
- Place of Presentation
  盛岡
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面非線形分光の分子シミュレーション計算手法の開発2010
- Author(s)
  森田明弘
- Organizer
  スーパーコンピューターワークショップ2010
- Place of Presentation
  岡崎
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] コンピュータシミュレーションと理論化学2010
- Author(s)
  森田明弘
- Organizer
  第4回分子シミュレーションスクール～基礎から応用まで～
- Place of Presentation
  岡崎
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Development of Theory on Surface Nonlinear Spectroscopy and Application to Liquid Interfaces2010
- Author(s)
  森田明弘
- Organizer
  International Symposium on Molecular Theory for Real Systems
- Place of Presentation
  Kyoto, Japan
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 塩基性水溶液表面でのOH-のふるまい2010
- Author(s)
  今村貴子, 石山達也, 森田明弘
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Development of Theory on Surface Nonlinear Spectroscopy and Application to Liquid Interfaces2010
- Author(s)
  森田明弘
- Organizer
  International Symposium on Molecular Theory for Real Systems
- Place of Presentation
  Kyoto, Japan
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] 界面及びバルクにおける誘起四極子を考慮した二次非線形分光の理論2010
- Author(s)
  白鳥和矢, 石山達也, 森田明弘
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面非線形分光の分子シミュレーション計算手法の開発2010
- Author(s)
  森田明弘
- Organizer
  スーパーコンピューターワークショップ2010
- Place of Presentation
  岡崎
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 重水素置換された水表面の振動和周波発生スペクトルの解析2010
- Author(s)
  李徳冠, 石山達也, 森田明弘
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 和周波発生スペクトルの解析を通した水/四塩化炭素及び水/1,2-ジクロロエタン界面構造の理解2010
- Author(s)
  佐藤祐史, 石山達也, 森田明弘
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 液体ベンゼンの界面における鯛波発生機構の解明2010
- Author(s)
  川口達也, 石山達也, 森田明弘
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] メチル基の分子内振動のモデリングと提動分光のシミュレーション2010
- Author(s)
  石山達也, Vladimir Sokolov, 森田明弘
- Organizer
  第24回分子シミュレーション討論会
- Place of Presentation
  福井
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Surface structure and vibrational spectrum at water surface:A molecul ar dynamics study2010
- Author(s)
  T.Ishiyama, A.Morita
- Organizer
  Pacifichem 2010 Symposium "Recent advances in studies of molecular processes at liquid interfaces"
- Place of Presentation
  Honolulu, Hawaii, USA.
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Theoretical Analysis on the Phase of Nonlinear Susceptibility at Water Surface2010
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride Science Research Center, Telluride, CO, USA
- Year and Date
  2010-06-21
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 和周波発生に基づいたベンゼンの気液界面の理論的解析2010
- Author(s)
  川口達也, 石山達也, 森田明弘
- Organizer
  平成22年度化学系学協会東北大会
- Place of Presentation
  盛岡
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Aqueous surfaces studied by sum frequency generation spectroscopy and molecular simulation2010
- Author(s)
  A.Morita
- Organizer
  Miniworkshop on Aqueous Interfaces in Physics
- Place of Presentation
  Taipei, Taiwan
- Year and Date
  2010-11-27
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computational analysis of nonlinear spectroscopy at water surface2010
- Author(s)
  A.Morita, T.Ishiyama
- Organizer
  Pacifichem 2010, Symposium"Molecular Dynamics in Complex Environments: Theory and Experiments
- Place of Presentation
  Honolulu, Hawaii, USA.
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 振動和周波分光計算のための振動かつ分極水モデルの開発2010
- Author(s)
  石山達也、森田明弘
- Organizer
  次世代スーパーコンピュータプロジェクトナノ統合拠点第4回公開シンポジウム
- Place of Presentation
  岡崎
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] F^-,OH^-水溶液のSFGスペクトル解析-硬いアニオンは気液界面に存在するか?-2009
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Structure of aqueous interfaces studied by MD analysis of SFG spectroscopy2009
- Author(s)
  森田明弘
- Organizer
  Telluride Science Research Conference on Chemistry and Dynamics in Complex Environments
- Place of Presentation
  Telluride, CO, USA
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 界面和周波発生分光の理論2009
- Author(s)
  森田明弘
- Organizer
  2009年度分子科学夏の学校
- Place of Presentation
  廿日市
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分子動力学と二次非線形分光を用いた空気/水界面における分子配向と溶媒和構造の研究2009
- Author(s)
  渡邊秀和、山口祥一、Sen Sobhan、森田明弘、田原太平
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] Development of Theory on Interfacial Sum Frequency Generation Spectroscopy based on Molecular Simulation2009
- Author(s)
  森田明弘
- Organizer
  特定研究「高次分子系」第3回公開シンポジウム
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 実験と理論の連携による溶液界面の分子科学2009
- Author(s)
  森田明弘
- Organizer
  第32回溶液化学シンポジウム
- Place of Presentation
  新潟
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 界面の二次非線形分光における局所電場の理論と界面誘電率の決定2009
- Author(s)
  白鳥和矢、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Structure of aqueous interfaces studied by MD analysis of SFG spectroscopy2009
- Author(s)
  A. Morita
- Organizer
  Telluride Science Research Conference on Chemistry and Dynamics in Complex Environments
- Place of Presentation
  Telluride Science Research Center, Telluride, CO, USA
- Year and Date
  2009-06-23
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面和周波発生分光の理論2009
- Author(s)
  森田明弘
- Organizer
  2009年度分子科学夏の学校
- Place of Presentation
  廿日
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] MD simulation of liquid methanol/vapour interface. Calculation and analysis of SFG spectrum2009
- Author(s)
  V.Sokolov、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水-有機溶媒界面のSFGシミュレーション2009
- Author(s)
  佐藤祐史、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] F^-, OH^-水溶液のSFGスペクトル解析-硬いアニオンは気液界面に存在するか?-2009
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Theoretical Phase Analysis of Nonlinear Susceptibility for Water Surface2009
- Author(s)
  A. Morita
- Organizer
  Mini-Workshop on Liquid Surfaces
- Place of Presentation
  Korea Sogang University, Seoul, Korea
- Year and Date
  2009-12-03
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computational Analysis of Sum Frequency Generation Spectroscopy and Aqueous Surfaces2009
- Author(s)
  森田明弘
- Organizer
  13th International Conference on Surface and Colloid Science
- Place of Presentation
  New York, NY, USA
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 電解質水溶液の界面構造と不均質大気化学での役割2009
- Author(s)
  森田明弘
- Organizer
  豊田理研特別課題研究「核形成の学理と応用」第3回研究会
- Place of Presentation
  京都
- Year and Date
  2009-11-07
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Theoretical Phase Analysis of Nonlinear Susceptibility for Water Surface2009
- Author(s)
  森田明弘
- Organizer
  Mini-Workshop on Liquid Surfaces
- Place of Presentation
  Seoul, Korea
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 分子シミュレーションで解明する液体界面と非線形分光2009
- Author(s)
  森田明弘
- Organizer
  日本コンピュータ化学会2009秋季大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] 実験と理論の連携による溶液界面の分子科学2009
- Author(s)
  森田明弘
- Organizer
  第32回溶液化学シンポジウム
- Place of Presentation
  新潟
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] 電解質水溶液の界面構造と不均質大気化学での役割2009
- Author(s)
  森田明弘
- Organizer
  豊田理研特別課題研究「核形成の学理と応用」第3回研究会
- Place of Presentation
  京都
- Year and Date
  2009-11-07
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 空気-水界面におけるクマリン分子の非線形感受率と分子配向についての理論的研究2009
- Author(s)
  渡邉秀和、山口祥一、森田明弘、南部伸孝、田原太平
- Organizer
  スーパーコンピューターワークショップ2009、次世代理論化学の新展開と超並列計算への挑戦
- Place of Presentation
  岡崎
- Data Source
  KAKENHI-PLANNED-19056009
[Presentation] 分子動力学と二次非線形分光を用いた空気/水界面における分子配向と溶媒和構造の研究2009
- Author(s)
  渡邊秀和、山口祥一、Sen Sobhan、森田明弘、田原太平
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] 分子シミュレーションで解明する液体界面と非線形分光2009
- Author(s)
  森田明弘
- Organizer
  日本コンピュータ化学会2009秋季大会
- Place of Presentation
  東北大学青葉山キャンパス青葉記念会館, 仙台
- Year and Date
  2009-11-13
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] NaF, NaOH水溶液の表面構造とSFGスペクトル2009
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Computational Analysis of Sum Frequency Generation Spectroscopy and Aqueous Surfaces2009
- Author(s)
  森田明弘
- Organizer
  13th International Conference on Surface and Colloid Science
- Place of Presentation
  New York, NY, USA
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 界面の二次非線形分光における局所電場効果2009
- Author(s)
  白鳥和矢、石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 界面和周波発生分光の理論2009
- Author(s)
  森田明弘
- Organizer
  2009年度分子科学夏の学校
- Place of Presentation
  廿日
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] 埋もれた界面の構造解析のための和周波分光の理論と計算科学2009
- Author(s)
  森田明弘
- Organizer
  第56回応用物理学会
- Place of Presentation
  筑波大学、つくば市
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Computational Analysis of Sum Frequency Generation Spectroscopy and Aqueous Surfaces2009
- Author(s)
  A. Morita
- Organizer
  13th International Conference on Surface and Colloid Science
- Place of Presentation
  Columbia University, New York, NY, USA
- Year and Date
  2009-06-16
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 実験と理論の連携による溶液界面の分子科学2009
- Author(s)
  森田明弘
- Organizer
  第32回溶液化学シンポジウム
- Place of Presentation
  新潟
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 液体メタノール/蒸気界面のMDシミュレーション-SFGスペクトルの計算と解析2009
- Author(s)
  V.Sokolov, 石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] NaF, NaOH水溶液の表面構造とSFGスペクトル2009
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 水表面における分子間配向相関の振動スペクトル応答2009
- Author(s)
  石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 埋もれた界面の構造解析のための和周波分光の理論と計算科学2009
- Author(s)
  森田明弘
- Organizer
  第56回応用物理学会
- Place of Presentation
  筑波大学、つくば市
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 界面の二次非線形分光における局所電場の理論と界面誘電率の決定2009
- Author(s)
  白鳥和矢、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 分子シミュレーションで解明する液体界面と非線形分光2009
- Author(s)
  森田明弘
- Organizer
  日本コンピュータ化学会2009秋季大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Computational Analysis of Sum Frequency Generation Spectroscopy and Aqueous Surfaces2009
- Author(s)
  森田明弘
- Organizer
  13th International Conference on Surface and Colloid Science
- Place of Presentation
  New York, NY, USA
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] MD simulation of liquid methanol/vapour interface. Calculation and analysis of SFG spectrum2009
- Author(s)
  V.Sokolov、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] Structure of aqueous interfaces studied by MD analysis of SFG spectroscopy2009
- Author(s)
  森田明弘
- Organizer
  Telluride Science Research Conference on Chemistry and Dynamics in Complex Environments
- Place of Presentation
  Telluride, CO, USA
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 和周波発生分光のMDシミュレーションの展開と応用2009
- Author(s)
  森田明弘
- Organizer
  理研シンポジウム「表面・界面を観る非線形分光の新しい展開」
- Place of Presentation
  理化学研究所、和光市
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Theoretical Phase Analysis of Nonlinear Susceptibility for Water Surface2009
- Author(s)
  森田明弘
- Organizer
  Mini-Workshop on Liquid Surfaces
- Place of Presentation
  Seoul, Korea
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分子シミュレーションで解明する液体界面と非線形分光2009
- Author(s)
  森田明弘
- Organizer
  日本コンピュータ化学会2009秋季大会
- Place of Presentation
  仙台
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 界面の二次非線形分光における局所電場効果2009
- Author(s)
  白鳥和矢、石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] F^-, OH^-水溶液のSFGスペクトル解析―硬いアニオンは気液界面に存在するか?―2009
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 水表面における分子間配向相関の振動スペクトル応答2009
- Author(s)
  石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] MD simulation of liquid methanol/vapour interface.Calculation and analysis of SFG spectrum2009
- Author(s)
  V.Sokolov、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] 液体メタノール/蒸気界面のMDシミュレーション-SFGスペクトルの計算と解析2009
- Author(s)
  V.Sokolov, 石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] 電解質水溶液の界面構造と不均質大気化学での役割2009
- Author(s)
  森田明弘
- Organizer
  豊田理研特別課題研究「核形成の学理と応用」第3回研究会
- Place of Presentation
  京都
- Year and Date
  2009-11-07
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分子動力学と二次非線形分光を用いた空気/水界面における分子配向と溶媒和構造の研究2009
- Author(s)
  渡邉秀和、山口祥一、SEN Sohban、森田明弘、田原太平
- Organizer
  分子科学討論会2009
- Place of Presentation
  名古屋大学、名古屋市
- Data Source
  KAKENHI-PLANNED-19056009
[Presentation] 和周波発生分光のMDシミュレーションの展開と応用2009
- Author(s)
  森田明弘
- Organizer
  理研シンポジウム「表面・界面を観る非線形分光の新しい展開」
- Place of Presentation
  理化学研究所、和光市
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 実験と理論の連携による溶液界面の分子科学2009
- Author(s)
  森田明弘
- Organizer
  第32回溶液化学シンポジウム
- Place of Presentation
  朱鷺メッセ, 新潟
- Year and Date
  2009-11-18
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面の二次非線形分光における局所電場効果2009
- Author(s)
  白鳥和矢、石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] 水-有機溶媒界面のSFGシミュレーション2009
- Author(s)
  佐藤祐史、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水表面における分子間配向相関の振動スペクトル応答2009
- Author(s)
  石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] NaF,NaOH水溶液の表面構造とSFGスペクトル2009
- Author(s)
  今村貴子、石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 水-有機溶媒界面のSFGシミュレーション2009
- Author(s)
  佐藤祐史、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 液体メタノール/蒸気界面のMDシミュレーション・SFGスペクトルの計算と解析2009
- Author(s)
  V.Sokolov, 石山達也、森田明弘
- Organizer
  日本化学会東北大会
- Place of Presentation
  郡山
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 界面の二次非線形分光における局所電場の理論と界面誘電率の決定2009
- Author(s)
  白鳥和矢、石山達也、森田明弘
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] 分子動力学と二次非線形分光を用いた空気/水界面における分子配向と溶媒和構造の研究2009
- Author(s)
  渡邊秀和、山口祥一、Sen Sobhan、森田明弘、田原太平
- Organizer
  第3回分子科学討論会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Structure of aqueous interfaces studied by MD analysis of SFG spectroscopy2009
- Author(s)
  森田明弘
- Organizer
  Telluride Science Research Conference on Chemistry and Dynamics in Complex Environments
- Place of Presentation
  Telluride, CO, USA
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Theoretical Phase Analysis of Nonlinear Susceptibility for Water Surface2009
- Author(s)
  森田明弘
- Organizer
  Mini-Workshop on Liquid Surfaces
- Place of Presentation
  Seoul, Korea
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Development of Theory on Interfacial Sum Frequency Generation Spear oscopy based on Molecular Simulation2009
- Author(s)
  森田明弘
- Organizer
  特定研究「高次分子系」第3向公開シシポジウム
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-21245002
[Presentation] Interface Structure of Electrolyte Aqueous Solutions Studied by a Combination of Sum Frequency Generation Spectroscopy and Molecular Simulation2008
- Author(s)
  A. Morita
- Organizer
  Telluride Science Conference on Liquid and Solid Aqueous Surfaces and Interfaces
- Place of Presentation
  Telluride, CO, USA
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] 分子シミュレーションに基づく和周波分光の理論の深化2008
- Author(s)
  森田明弘
- Organizer
  特定領域研究「高次分子系」第2回公開シンポジウム
- Place of Presentation
  大阪大学、吹田市
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] Molecular Dynamics Analysis of Vibrational Sum Frequency Generation Spectroscopy2008
- Author(s)
  A. Morita
- Organizer
  Telluride Science Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride, CO, USA
- Data Source
  KAKENHI-PROJECT-20050003
[Presentation] Molecular Dynamics Analysis of Vibrational Sum Frequency Generation Spectroscopy2008
- Author(s)
  A. Morita
- Organizer
  Telluride Science Conference on Nonlinear Optics at Interfaces
- Place of Presentation
  Telluride, CO, USA
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] Interface Structure of Electrolyte Aqueous Solutions Studied by a Comb ination of Sum Frequency Generation Spectroscopy and Molecular Simul ation2008
- Author(s)
  A. Morita
- Organizer
  Telluride Science Conference on Liquid and Solid Aqueous Surfaces and Interfaces
- Place of Presentation
  Telluride, CO, USA
- Data Source
  KAKENHI-PROJECT-20038003
[Presentation] SFG分光法を用いた硫酸水溶液表面の解離状態2007
- Author(s)
  宮前孝行, 森田明弘, 大内幸雄
- Organizer
  第27回表面科学講演大会
- Place of Presentation
  東京大学
- Year and Date
  2007-11-02
- Data Source
  KAKENHI-PROJECT-18550025
[Presentation] 和周波発生分光法による硫酸水溶液表面の研究2007
- Author(s)
  宮前孝行, 森田明弘, 大内幸雄
- Organizer
  第87回日本化学会春季年会
- Place of Presentation
  関西大学
- Year and Date
  2007-03-26
- Data Source
  KAKENHI-PROJECT-18550025
[Presentation] 和周波発生(SFG)分光法による硫酸水溶液表面の研究2007
- Author(s)
  宮前孝行, 森田明弘, 大内幸雄
- Organizer
  第1回分子科学討論会
- Place of Presentation
  東北大学
- Year and Date
  2007-09-18
- Data Source
  KAKENHI-PROJECT-18550025
[Presentation] Computational Analysis of Interfacial SFG Spectroscopy2007
- Author(s)
  A. Morita
- Organizer
  第234回アメリカ化学会全国大会
- Place of Presentation
  ボストン・コンベンションセンター(米国)
- Data Source
  KAKENHI-PROJECT-19029043
[Presentation] 和周波発生分光でプローブされる水溶性界面の電気二重層構造2007
- Author(s)
  森田明弘
- Organizer
  第10回理論化学討論会
- Place of Presentation
  名古屋大学
- Data Source
  KAKENHI-PROJECT-19029043

1. ISHIYAMA Tatsuya (10421364)

# of Collaborated Projects: 6 results

# of Collaborated Products: 179 results
2. OOUCHI Yukio (60194081)

# of Collaborated Projects: 5 results

# of Collaborated Products: 10 results
3. MIYAMAE Takayuki (80358134)

# of Collaborated Projects: 3 results

# of Collaborated Products: 6 results
4. TAHARA Tahei (60217164)

# of Collaborated Projects: 3 results

# of Collaborated Products: 22 results
5. KATO Shigeki (20113425)

# of Collaborated Projects: 2 results

# of Collaborated Products: 2 results
6. 橋本健朗 (40202254)

# of Collaborated Projects: 2 results

# of Collaborated Products: 0 results
7. ISHII Hisao (60232237)

# of Collaborated Projects: 1 results

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8. NOGUCHI Yutaka (20399538)

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9. TAKEUCHI Satoshi (50280582)

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10. YAMAGUCHI Shoichi (60250239)

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11. ISHII Kunihiko (80391853)

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12. HOSOI Haruko (00313396)

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13. ASANO Motoko (80201888)

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14. SHIRATORI Kazuya (10507908)

# of Collaborated Projects: 1 results

# of Collaborated Products: 17 results
15. TAKAHASHI Hideaki (10291436)

# of Collaborated Projects: 1 results

# of Collaborated Products: 41 results
16. JOUTSUKA Tatsuya (70823003)

# of Collaborated Projects: 1 results

# of Collaborated Products: 19 results
17. SUGIYAMA Masakazu (90323534)

# of Collaborated Projects: 1 results

# of Collaborated Products: 12 results
18. HAYASHI Shigehiko (70402758)

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19. TAKAHASHI Satoshi (30283641)

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20. MURAHASHI Tetsuro (40314380)

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21. NAKANISHI Takashi (40391221)

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22. 長村吉洋 (50160841)

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23. 中辻博 (90026211)

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24. 榊茂好 (20094013)

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25. 波田雅彦 (20228480)

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26. 江原正博 (80260149)

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27. 長谷川淳也 (30322168)

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28. 西直哉 (10372567)

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29. 神取秀樹 (70202033)

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32. 藤井正明 (60181319)

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33. 二本柳聡史 (30443972)

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34. SUGIMOTO Toshiki

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35. 井上賢一

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36. 石橋孝章

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37. 近藤正人

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38. 田中拓男

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39. 岩橋崇

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40. 松林伸幸

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41. 渡部直樹

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MORITA Akihiro 森田 明弘

Research Projects

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Co-Researchers

一般化自由エネルギー計算とマルチスケールMDに基づく液液界面の分子理論の発展Principal Investigator

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Development of theory on sum frequency generation spectroscopyPrincipal Investigator

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Microscopic theory of phase transfer catalysis at liquid-liquid interfacesPrincipal Investigator

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Theory of Structure and Functions of Liquid and Polymer InterfacesPrincipal Investigator

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Theory and computational method of interfacial sum frequency generation spectrosocpyPrincipal Investigator

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実験と理論計算の連携による溶液界面構造の微視的解明Principal Investigator

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分子シミュレーションに基づく和周波発生の理論の深化Principal Investigator

Principal Investigator

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Review Section

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実験と理論計算の連携による界面和周波分光の解析Principal Investigator

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MORITA Akihiro 森田明弘