MIZUSEKI Hiroshi 水関博志

… Alternative Names

MIZUZEKI Hiroshi 水関博志

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Researcher Number	00271966
Other IDs	https://orcid.org/0000-0003-0973-7693
Affiliation (based on the past Project Information) *help	2014: 韓国科学技術研究院, 主幹研究員 2007 – 2014: 東北大学, 金属材料研究所, 准教授 2006: Tohoku University, Institute for Materials Research, Associate Professor 2005 – 2006: Tohoku University, Institute for Materials Research, Associate Professor, 金属材料研究所, 助教授 2003 – 2004: 東北大学, 金属材料研究所, 助手 1997 – 2001: 東北大学, 金属材料研究所, 助手
Review Section/Research Field	Principal Investigator Energy engineering / Nanomaterials/Nanobioscience / Structural/Functional materials Except Principal Investigator Nanostructural science / Environmental technology/Environmental materials / Nanomaterials/Nanobioscience / Applied materials science/Crystal engineering / Physical properties of metals / Inorganic materials/Physical properties / Structural/Functional materials / Inorganic materials/Physical properties / Media informatics/Database
Keywords	Principal Investigator 第一原理計算 / 材料設計 / シミュレーション / 相図作成 / エネルギー貯蔵 / コンピューターシミュレーション / ガス貯蔵材料 / ガスハイドレート / クラスレートハイドレート / 単一公子素子 … More / グリーン関数法 / 分子ワイヤー / 量子コンダクタンス / 遺伝的アルゴリズム / 単一分子素子 / 分子狭窄系 / 分子架橋系 / 分子デバイス / 量子コダクタンス / 遺伝的アルゴズム / 非平衡グリーン関数法 / Hysteresis Loop / クラスター推積法 / 材料予測 / クラスター堆積法 / 3次元ナノ構造体 / モンテカルロ直接法 / 分子気体 / 希薄流 / モンテカルロ・シミュレーション / 多値記録 / 超高密度磁気記録材料 … More Except Principal Investigator 第一原理計算 / 材料設計 / ナノテクノロジー / スーパーコンピューター / 水素ハイドレート / functional materials / 機能性材料 / 多層膜 / シミュレーション / シミュレーション研究 / 水素貯蔵材料 / 全電子混合基底法 / 数値シミュレーション / MOF / 有機金属構造体 / THF / プロパン / 吸着エネルギー / 分子動力学 / 格子力学 / 自己保存効果 / 熱力学的性質 / 動力学的安定性 / silicon polymer / hybrid model / first principles calculations / rarefied gas / direct simulation Monte Carlo / cluster growth / n-electron materials / silicon particle / 機能性薄膜 / 金属内包シリコンクリスター / 階層化モデル / ケイ素重合体 / ハイブリッドモデル / 希薄流 / モンテカルロ直接法 / クラスター成長 / π電子材料 / シリコン系ナノ粒子 / material design / first principle calculations / nano structure / nanotechnology / nanocluster / silicon nanotube / metal encapsulated silicon fullerene / ナノ構造体 / ナノクラスター / シリコンナノチューブ / 金属内包シリコンフラーレン / materials design / Marangoni convection / computational fluid dynamics / Eutectic materials / micro pulling down method / crystal growth / photonic crystal / マランゴニ対流 / 流体計算 / 共晶体 / マイクロ引き下げ法 / 単結晶育成 / フォトニック結晶 / Low dimensional / Nanotechnology / Supercomputer / Simulation / First Principles calculation / High density / Magnetic cluster / Magnetic recording / タイトバインディング法 / 超高密度記録メディア / 相互作用パラメーター / 大規模系 / 高密度記録メディア / 分子動力学法 / 遷移金属クラスター / 低次元系 / 魔法数 / モンテカルロ法 / シュミレーション / 第一原理 / 異方性 / 磁性 / クラスター / 低次元材料 / 高密度 / 磁性クラスター / 磁気記録 / ferroelectric material / nano composite / gold / silica / titania / functionally gradient materials / optical functional film / multi-layer thin film / 光学特性 / 傾斜機能 / 透過率 / 屈折率 / 最適化設計 / 光機能特性 / 金属粒子 / ナノ多層膜 / 誘電体 / ナノ複合 / 金 / 酸化シリコン / 酸化チタン / 傾斜機能材料 / 光機能薄膜 / 複合多層薄膜 / キャリア密度 / ゼーベック係数 / 熱電材料 / 熱電変換素子 / 電気伝導 / 熱伝導 / 熱電変換の物性理論 / ワニエ関数 / 全電子混合基底法開発 / 熱電変換の物性理論 / 熱伝導率算定 / 非調和格子振動算定 / 時間依存密度汎関数理論 / 電子励起状態 / ホウ化物 / 解離反応 / 密度汎関数理論 / 解離 / 統計処理 / 知識発見 / 高性能計算 / 分子 / データマイニング / スピルオーバー過程 / Al(111)表面 / ナノチューブ / 水素貯蔵重量比 / 金属酸化物構造体 / ファンデルワールス力 / 材料探索 / 時間依存DFT計算 / クラスレート水和物 / グラフェン / van der Waals力 / 抱接分子 / 水素・水素相互作用 / 吸着 / 有機金属系構造体 / キラリティー / 収着特性 / 水素クラスレートハイドレート / 対掌性 / 収着 / マイクロポーラス材料 / ミクロ孔金属錯体物質 / 熱力的性質 / メタン / メタンハイドレート / 吸着工ネルギー / 金属機構造体 / 格子動力学 / ヘルプガス / 動的安定性 / 金属有機構造体 / 核形成メカニズム / 熱力学的安定性 / 核形成機構 / ガスハイドレート Less

Theoretical investigation and design of high density hydrogen storage materials using spill over process
- Principal Investigator
  
  RYOJI Sahara
- Project Period (FY)
  2012 – 2014
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Inorganic materials/Physical properties
- Research Institution
  National Institute for Materials Science
Theoretical design of thermal condutive- and thermoelectric- devices by all electron mixed basis ab initio calculatio
- Principal Investigator
  
  KAWAZOE Yoshiyuki
- Project Period (FY)
  2012 – 2013
- Research Category
  
  Grant-in-Aid for Challenging Exploratory Research
- Research Field
  
  Structural/Functional materials
- Research Institution
  Tohoku University
Gas Storage Materials by Ice at Ordinary Temperatures and PressuresPrincipal Investigator
- Principal Investigator
  
  MIZUSEKI Hiroshi
- Project Period (FY)
  2012 – 2013
- Research Category
  
  Grant-in-Aid for Challenging Exploratory Research
- Research Field
  
  Energy engineering
- Research Institution
  Tohoku University
Ultra high-performance and -reliablity design of metal-organic materials for high-density hydrogen storage
- Principal Investigator
  
  KAWAZOE Yoehiyuki
- Project Period (FY)
  2011 – 2014
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Research Field
  
  Environmental technology/Environmental materials
- Research Institution
  Tohoku University
Simulation-based material design system using data mining
- Principal Investigator
  
  HAYASHI Ryoko
- Project Period (FY)
  2011 – 2013
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Media informatics/Database
- Research Institution
  Kanazawa Institute of Technology
Evaluation and Survey of Electron Transport through Organic Molecules for Molecular DevicesPrincipal Investigator
- Principal Investigator
  
  MIZUSEKI Hiroshi
- Project Period (FY)
  2009 – 2011
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Nanomaterials/Nanobioscience
- Research Institution
  Tohoku University
ナノポーラスを制御したガス吸蔵材料の設計
- Principal Investigator
  
  ベロスルドフロディオン (BELOSLUDOV R.V.)
- Project Period (FY)
  2007 – 2009
- Research Category
  
  Grant-in-Aid for Challenging Exploratory Research
- Research Field
  
  Nanostructural science
- Research Institution
  Tohoku University
Theoretical Design of Nanoporous Materials for Hydrogen Storage Materials
- Principal Investigator
  
  KAWAZOE Yoshiyuki
- Project Period (FY)
  2006 – 2008
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Nanostructural science
- Research Institution
  Tohoku University
新エネルギー資源としてのクラスレートハイドレートの相安定性検討
- Principal Investigator
  
  BELOSLUDOV Rodion
- Project Period (FY)
  2005 – 2006
- Research Category
  
  Grant-in-Aid for Exploratory Research
- Research Field
  
  Environmental technology/Environmental materials
- Research Institution
  Tohoku University
Cluster growth and deposition processes and novel properties by hybrid model
- Principal Investigator
  
  TAKAHASHI Masae
- Project Period (FY)
  2004 – 2006
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Nanomaterials/Nanobioscience
- Research Institution
  Tohoku University
Design and melt growth for novel photonic crystals by micro pulling down method
- Principal Investigator
  
  KAWAZOE Yoshiyuki
- Project Period (FY)
  2003 – 2005
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Applied materials science/Crystal engineering
- Research Institution
  Tohoku University
Prediction of Stable structure and properties for new silicon nanowire
- Principal Investigator
  
  MARCEL Sluiter
- Project Period (FY)
  2003 – 2004
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Nanostructural science
- Research Institution
  Tohoku University
Design and preparation of ferroelectric-metal nano-FGM multi-layer films
- Principal Investigator
  
  HIRAI Toshio
- Project Period (FY)
  1999 – 2000
- Research Category
  
  Grant-in-Aid for Scientific Research (A).
- Research Field
  
  Inorganic materials/Physical properties
- Research Institution
  TOHOKU UNIVERSITY
Application of new magnetism produced by low dimentional materials to realize ultra high density recording media
- Principal Investigator
  
  KAWAZOE Yoshiyuki
- Project Period (FY)
  1999 – 2001
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Physical properties of metals
- Research Institution
  Tohoku University
磁性人工格子を用いた多値記録手法による超高密度磁気記録材料への応用研究Principal Investigator
- Principal Investigator
  
  水関博志
- Project Period (FY)
  1997 – 1998
- Research Category
  
  Grant-in-Aid for Encouragement of Young Scientists (A)
- Research Field
  
  Structural/Functional materials
- Research Institution
  Tohoku University

All 2014 2013 2012 2011 2010 2009 2008 2006 2005 2004 Other

All Journal Article Presentation Book

[Book] 水素利用技術集成2014
- Author(s)
  佐原亮二、水関博志、Marcel H. F. Sluiter、大野かおる、川添良幸
- Total Pages
  6
- Publisher
  エヌティーエス出版
- Data Source
  KAKENHI-PROJECT-24560813
[Book] 水素利用技術集成Vol. 4(担当した章のタイトル: 全電子混合基底法プログラムを用いた水素貯蔵材料設計)2014
- Author(s)
  佐原亮二、水関博志、Marcel H. F. Sluiter、大野かおる、川添良幸
- Total Pages
  7
- Publisher
  エヌ・ティー・エス出版
- Data Source
  KAKENHI-PROJECT-24560813
[Journal Article] Theoretical Study of Hydrogen Storage in Binary Hydrogen-methane Clathrate Hydrates2014
- Author(s)
  R. V. Belosludov, R. K. Zhdanov, O. S. Subbotin, H. Mizuseki Y. Kawazoe and V. R. Belosludov
- Journal Title
  
  J. Renewable Sustainable Energy
  
  Volume: 6 Issue: 5 Pages: 053132-053132
- DOI
  10.1063/1.4899075
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] Hydrogen storage in TiO2 functionalized (10, 10) single walled carbon nanotube (SWCNT) e First principles study2014
- Author(s)
  R. Lavanya, V.J. Surya, I. Lakshmi, K. Iyakutti, V. Vasu, H. Mizuseki and Y. Kawazoe
- Journal Title
  
  Int. J. Hydrogen Energy
  
  Volume: 39 Issue: 10 Pages: 4973-4980
- DOI
  10.1016/j.ijhydene.2014.01.048
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] “Stability and Composition of Helium Hydrates Based on Ices Ih and II at Low Temperatures”2014
- Author(s)
  Rodion V. Belosludov, Yulia Y. Bozhko, Oleg S. Subbotin,‡ Vladimir R. Belosludov, Hiroshi Mizuseki, Yoshiyuki Kawazoe, and Vasily M. Fomin,
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: vol.118, iss.5 Issue: 5 Pages: 2587-2593
- DOI
  10.1021/jp411241s
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027, KAKENHI-PROJECT-24656575
[Journal Article] Engineering of Band Gap in Metal－Organic Frameworks by Functionalizing Organic Linker: A Systematic Density Functional Theory Investigation2014
- Author(s)
  Hung Q. Pham, Toan Mai, Nguyen-Nguyen Pham-Tran, Yoshiyuki Kawazoe, Hiroshi Mizuseki and Duc Nguyen-Manh
- Journal Title
  
  J. Phys. Chem. C
  
  Volume: 118 Pages: 4567-4577
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] 計算科学とデータマイニングを用いた材料設計システム2014
- Author(s)
  林亮子, 水関博志
- Journal Title
  
  FIT2014第13回情報科学技術フォーラム
- Data Source
  KAKENHI-PROJECT-23500138
[Journal Article] 分散処理とデータ処理技術を利用した分子設計システム2013
- Author(s)
  林亮子, 水関博志
- Journal Title
  
  情報処理学会研究報告
  
  Volume: Vol. 2013-MPS-96, No. 26
- NAID
  110009634048
- Data Source
  KAKENHI-PROJECT-23500138
[Journal Article] Theoretical Modelling of the Phase Diagrams of Clathrate Hydrates for Hydrogen Storage Applications2012
- Author(s)
  R. V. Belosludov, R. K. Zhdanov, O. S. Subbotin, H. Mizuseki, M. Souissi, Y. Kawazoe, and V. R. Belosludov
- Journal Title
  
  Mol. Sim.
  
  Volume: 38 Issue: 10 Pages: 773-780
- DOI
  10.1080/08927022.2011.654204
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027, KAKENHI-PROJECT-24656575
[Journal Article] Theoretical Investigation of Ozone Hydrate Formation Conditions2012
- Author(s)
  O. S. Subbotin, T. P. Adamova, R. V. Belosludov, H. Mizuseki, Y. Kawazoe, and V. R. Belosludov
- Journal Title
  
  J. Str. Chem.
  
  Volume: 53 Pages: 627-633
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] An Atomistic Level Description of Guest Molecule Effect on the Formation of Hydrate Crystal Nuclei by Ab Initio Calculations2012
- Author(s)
  R. V. Belosludov, H. Mizuseki, M. Souissi, Y. Kawazoe, J. Kudoh, O. S. Subbotin, T. Adamova, and V. R. Belosludov
- Journal Title
  
  J. Str. Chem.
  
  Volume: 53 Pages: 619-626
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] An Atomistic Level Description of Guest Molecule Effect on the Formation of Hydrate Crystal Nuclei by Ab Initio Calculations2012
- Author(s)
  R. V. Belosludov, H. Mizuseki, M. Souissi, Y. Kawazoe, J. Kudoh, O. S. Subbotin, T. Adamova, and V. R. Belosludov
- Journal Title
  
  J. Str. Chem.
  
  Volume: 53 Pages: 619-626
- Data Source
  KAKENHI-PROJECT-24656575
[Journal Article] Theoretical Investigation of Ozone Hydrate Formation Conditions2012
- Author(s)
  O. S. Subbotin, T. P. Adamova, R. V. Belosludov, H. Mizuseki, Y. Kawazoe, and R. Belosludov
- Journal Title
  
  J.Str.Chem.
  
  Volume: 53 Pages: 627-633
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-24656575
[Journal Article] Theoretical Investigation of Ozone Hydrate Formation Conditions2012
- Author(s)
  O. S. Subbotin, T. P. Adamova, R. V. Belosludov, H. Mizuseki, Y. Kawazoe, and V. R. Belosludov
- Journal Title
  
  J. Str. Chem.
  
  Volume: 53 Pages: 627-633
- Data Source
  KAKENHI-PROJECT-24656575
[Journal Article] Calcium-decorated Graphene for Hydrogen Storage : A van der Waals Density Functional Study2012
- Author(s)
  V.Wang, H.Mizuseki, H.P.He, G.Chen, S.L.Zhang, Y.Kawazoe
- Journal Title
  
  Comput.Mater.Sci.
  
  Volume: 55 Pages: 180-185
- DOI
  10.1016/j.commatsci.2011.12.006
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] An Atomistic Level Description of Guest Molecule Effect on the Formation of Hydrate Crystal Nuclei by Ab Initio Calculations2012
- Author(s)
  R. V. Belosludov, H. Mizuseki, M. Souissi, Y. Kawazoe, J. Kudoh, O. S. Subbotin, T. Adamova, and V. R. Belosludov
- Journal Title
  
  J.Str.Chem.
  
  Volume: 53 Pages: 619-626
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-24656575
[Journal Article] Modification of Graphene as Active Hydrogen Storage Medium by Strain Engineering2012
- Author(s)
  V. J. Surya, K. Iyakutti, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  Comput. Mater. Sci.
  
  Volume: 65 Pages: 144-148
- DOI
  10.1016/j.commatsci.2012.07.016
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] First-principles Study of the H_2 Splitting Processes on Pure and Transition-metal-doped Al (111) Surfaces2011
- Author(s)
  Q.Peng, G.Chen, L.J.Kang, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  Int.J.Hydrogen Energy
  
  Volume: 36 Issue: 20 Pages: 12742-12752
- DOI
  10.1016/j.ijhydene.2011.07.052
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] Hydrogenation-chain-opened Conductive Channels in Zigzag Graphene Nanoribbons2011
- Author(s)
  D.-D. Wu, F. Jiang, G. Yin, H. Chen, Y.-Y. Liang, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  J. Appl. Phys
  
  Volume: 110 Pages: 33712-33712
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] First Principles Investigation on Carbon Nanostructures Functionalized with Borane : An Analysis on their Hydrogen Storage Capacity2011
- Author(s)
  V.J.Surya, K.Iyakutti, V.P.Venkatesh, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  Physica E
  
  Volume: 43 Issue: 9 Pages: 1528-1534
- DOI
  10.1002/pssb.201046532
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] ydrogenation-chain-opened Conductive Channels in Zigzag Graphene Nanoribbon2011
- Author(s)
  D.-D.Wu, F.Jiang, G.Yin, H.Chen, Y.-Y.Liang, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  J.Appl.Phys.
  
  Volume: 110 Issue: 3 Pages: 33712-33712
- DOI
  10.1063/1.3614496
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] First Principles Study on Desorption of Chemisorbed Hydrogen Atoms from Singie-walled Carbon Nanotubes under External Electric Field2011
- Author(s)
  V.J.Surya, K.Iyakutti, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  Int.J.Hydrogen Energy
  
  Volume: 36 Issue: 21 Pages: 13645-13656
- DOI
  10.1016/j.ijhydene.2011.08.015
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23241027
[Journal Article] Gate-controlled Current and Inelastic Electron Tunneling Spectrum of Benzene : A Self-consistent Study2011
- Author(s)
  Y.-Y.Liang, H.Chen, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  J.Chem.Phys.
  
  Volume: 134 Issue: 14 Pages: 144113-144113
- DOI
  10.1063/1.3571475
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Electron Transport Characteristics of Organic Molecule Encapsulated Carbon Nanotubes2011
- Author(s)
  S. U. Lee, R. V. Belosludov, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  Nanoscale
  
  Volume: 3 Pages: 1773-1779
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Gate-controlled Current and Inelastic Electron Tunneling Spectrum of Benzene : A Self-consistent Study2011
- Author(s)
  Y.-Y. Liang, H. Chen, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  J. Chem. Phys
  
  Volume: 134 Pages: 144113-144113
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Rigid Adamantane Tripod Linkage for Well-defined Conductance of a Single-molecule Junction2010
- Author(s)
  S.-U.Lee, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  Phys.Chem.Chem.Phys.
  
  Volume: 12 Pages: 11763-11769
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Rigid Adamantane Tripod Linkage for Well-defined Conductance of a Single-molecule Junction2010
- Author(s)
  S. U. Lee, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  Chem. Phys
  
  Volume: 12 Pages: 11763-11769
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Self-Consistent Study of Conjugated Aromatic Molecular Transistors2010
- Author(s)
  J. Wang, Y.-Y. Liang, H. Chen, P. Wang, R. Note, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  Chin. Phys. Lett
  
  Volume: 27 Pages: 67303-67303
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Electron Transport Characteristics of One-Dimensional Heterojunctions with Multi-Nitrogen-Doped Capped Carbon Nanotubes2010
- Author(s)
  S.-U.Lee, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  Nanoscale
  
  Volume: 2 Pages: 2578-2764
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Electron Transport Characteristics of One-Dimensional Heterojunctions with Multi-Nitrogen-Doped Capped Carbon Nanotubes2010
- Author(s)
  S. U. Lee, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  Nanoscale
  
  Volume: 2 Pages: 2758-2764
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Electron Transport Characteristics of Organic Molecule Encapsulated Carbon Nanotubes2010
- Author(s)
  S.-U.Lee, R.V.Belosludov, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  Nanoscale
  
  Volume: 3 Pages: 1773-1779
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] A Theoretical Study on the Interaction of Aromatic Amino Acids with Graphene and Single Walled Carbon Nanotube2009
- Author(s)
  C.Rajesh, C.Majumder, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  J.Chem.Phys. 130
  
  Pages: 124911-124911
- NAID
  120002338322
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Polarization Induced Switching Effect in Graphene Nanoribbon Edge-Defect Junction2009
- Author(s)
  G.Yin, Y.Y. Liang, F.Jiang, H.Chen, P.Wang, R.Note, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  J.Chem.Phys. 131
  
  Pages: 234706-234706
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Polarization Induced Switching Effect in Graphene Nanoribbon Edge-Defect Junction2009
- Author(s)
  G. Yin, Y.-Y. Liang, F. Jiang, H. Chen, P. Wang, R. Note, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  J. Chem. Phys
  
  Volume: 131 Pages: 234706-234706
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Accurate Description of Phase Diagram of Clathrate Hydrates at the Molecular Level2009
- Author(s)
  R.V.Belosludov, O.P.Subbotin, H.Mizuseki, Y.Kawazoe, V.R.Belosludov
- Journal Title
  
  J.Chem.Phys. 131
  
  Pages: 244510-244510
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19651039
[Journal Article] A Theoretical Study on the Interaction of Aromatic Amino Acids with Graphene and Single Walled Carbon Nanotube2009
- Author(s)
  C. Rajesh, C. Majumder, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  J. Chem. Phys
  
  Volume: 130 Pages: 124911-124911
- NAID
  120002338322
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Designing Nanogadgetry for Nanoelectronic Devices with Nitrogen-Doped Capped Carbon Nanotubes2009
- Author(s)
  S. U. Lee, R. V. Belosludov, H. Mizuseki, and Y. Kawazoe
- Journal Title
  
  Small
  
  Volume: 5 Pages: 1769-1775
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Designing Nanogadgetry for Nanoelectronic Devices with Nitrogen-Doped Capped Carbon Nanotubes2009
- Author(s)
  Sang Uck Lee, R.V. Belosludov, H.Mizuseki, Y.Kawazo
- Journal Title
  
  Small 5
  
  Pages: 1769-1775
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21310068
[Journal Article] Crystal-like low frequency phonons in the low-density amorphous and high-density amorphous ices2008
- Author(s)
  R. V. Belosludov, O. S. Subbotin, H. Mizuseki, P. M. Rodger, Y. Kawazoe and V. R. Belosludov
- Journal Title
  
  J. Chem. Phys. 129
  
  Pages: 114507-114507
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18310067
[Journal Article] Crystal-like Low Frequency Phonons in the Low-density Amorphous and High-density Amorphous Ices2008
- Author(s)
  R. V. Belosludov, O. S. Subbotin, H. Mizuseki, P. M. Rodger, Y. Kawazoe, and V. R. Belosludov
- Journal Title
  
  J. Chem. Phys 129
  
  Pages: 114507-114507
- Data Source
  KAKENHI-PROJECT-19651039
[Journal Article] Excited State Properties and Quadratic Optical Nonlinearities in Charged Organic Chromophores : Theoretical Analysis2006
- Author(s)
  T.M.Inerbaev, S.Saito, R.V.Belosludov, H.Mizuseki, M.Takahashi, Y.Kawazoe
- Journal Title
  
  J.Chem.Phys. 125
  
  Pages: 234702-234702
- NAID
  120002338314
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] First Excited State Properties and Static Hyperpolarizability of Ruthenium(II) Ammine Complexes2006
- Author(s)
  T.M.Inerbaev, R.V.Belosludov, H.Mizuseki, M.Takahashi, Y.Kawazoe
- Journal Title
  
  J. Chem. Theory and Comput. 2
  
  Pages: 1325-1334
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] First Excited State Properties and Static Hyperpolarizability of Ruthenium(II) Ammine Complexes2006
- Author(s)
  T.M.Inerbaev, R.V.Belosludov, H.Mizuseki, M.Takahashi, Y.Kawazoe
- Journal Title
  
  J.Chem.Theory and Comput. 2
  
  Pages: 1325-1334
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] Excited State Properties and Quadratic Optical Nonlinearities in Charged Organic Chromophores : Theoretical Analysis2006
- Author(s)
  T.M.Inerbaev, S.Saito, R.V.Belosludov, H.Mizuseki, M.Takahashi, Y.Kawazoe
- Journal Title
  
  J. Chem. Phys 125
  
  Pages: 234702-234702
- NAID
  120002338314
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] Atomic and Electronic Structures of Neutral and Cation Snn (n=2-20) Clusters : A Comparative Theoretical Study with Different Exchange-correlation Functionals2005
- Author(s)
  C.Majumder, V.Kumar, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  Phys.Rev.B 71
  
  Pages: 35401-35401
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] Atomic and Electronic Structures of Neutral and Cation Sn_n (n=2-20) Clusters : A Comparative Theoretical Study with Different Exchange-correlation Functionals2005
- Author(s)
  C.Majumder, V.Kumar, H.Mizuseki, Y.Kawazoe
- Journal Title
  
  Phys. Rev. B 71
  
  Pages: 35401-35401
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] First-principles Study on the Electronic Structures of Icosahedral Ti_N (N = 13, 19, 43, 55) Clusters2004
- Author(s)
  S.-Y.Wang, J.-Z.Yu, H.Mizuseki, J.-A.Yan, Y.Kawazoe, C.-Y.Wang
- Journal Title
  
  J. Chem. Phys. 120
  
  Pages: 8463-8468
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] First-principles Study on the Electronic Structures of Icosahedral TiN (N=13,19,43,55) Clusters2004
- Author(s)
  S.-Y.Wang, J.-Z.Yu, H.Mizuseki, J.-A.Yan, Y.Kawazoe, C.-Y.Wang
- Journal Title
  
  J.Chem.Phys. 120
  
  Pages: 8463-8468
- NAID
  120002338309
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] Energetics and Local Spin Magnetic Moment of Single 3,4d Impurities Encapsulated in an Icosahedral Au_<12> Cage2004
- Author(s)
  S.-Y.Wang, J.-Z.Yu, H.Mizuseki, Q.Sun, C.-Y.Wang, Y.Kawazoe
- Journal Title
  
  Phys. Rev. B 70
  
  Pages: 165413-165413
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Journal Article] Energetics and Local Spin Magnetic Moment of Single 3,4d Impurities Encapsulated in an Icosahedral AU12 Cage2004
- Author(s)
  S.-Y.Wang, J.-Z.Yu, H.Mizuseki, Q.Sun, C.-Y.Wang, Y.Kawazoe
- Journal Title
  
  Phys.Rev.B 70
  
  Pages: 165413-165413
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310080
[Presentation] 計算科学とデータマイニングを用いた材料設計システム2014
- Author(s)
  林亮子，水関博志
- Organizer
  FIT2014情報科学技術フォーラム
- Place of Presentation
  筑波大学
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] データマイニング技術を用いたシミュレーション結果自動分類の試み2014
- Author(s)
  林亮子, 水関博志
- Organizer
  ナノ学会第12回大会
- Place of Presentation
  京都大学, 京都府宇治市
- Year and Date
  2014-05-22
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] データマイニング技術を用いたシミュレーション結果自動分類の試み2014
- Author(s)
  林亮子，水関博志
- Organizer
  ナノ学会　第１２回大会
- Place of Presentation
  京都大学
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] 粗放的シミュレーション実行に基づく分子設計支援システムの試み2013
- Author(s)
  林亮子, 水関博志
- Organizer
  第３６回情報化学討論会
- Place of Presentation
  筑波大学
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] “Formalism for Calculation Van der Waals Dispersion Coefficients within the All-electron Mixed-basis Approach”2013
- Author(s)
  V. R. Belosludov O. S. Subbotin, R. V. Belosludov, H. Mizuseki and Y. Kawazoe,
- Organizer
  The Eighth General Meeting of Asian Consortium on Computational Materials Science - Virtual Organization (8thACCMS-VO)
- Place of Presentation
  Tohoku University,Sendai,Japan
- Invited
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] Modeling on Storage Properties in Potential Hydrogen Storage Media2013
- Author(s)
  H. Mizuseki
- Organizer
  8th Pacific Rim International Congress on Advanced Materials and Processing (PRICM-8)
- Place of Presentation
  Waikoloa, HI, U.S.A.
- Data Source
  KAKENHI-PROJECT-24656575
[Presentation] Simulation Study of Gas Storage Materials based on Clathrate Hydrates2013
- Author(s)
  H. Mizuseki, R. V. Belosludov, O. S Subbotin, V. Belosludov, and Y. Kawazoe
- Organizer
  The 3rd AICS International Symposium
- Place of Presentation
  Kobe, Japan
- Data Source
  KAKENHI-PROJECT-24656575
[Presentation] Introduction of TOMBO ~ Development of hydrogen storage materials ~2013
- Author(s)
  R. Sahara, H. Mizuseki, M. Sluiter, K. Ohno, and Y. Kawazoe
- Organizer
  Working Group Meeting of Asian Consortium on Computational Materials Science
- Place of Presentation
  National Taiwan University of Science and Technology
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] IT と分子シミュレーションを用いた分子設計システム2013
- Author(s)
  林　亮子，水関　博志
- Organizer
  ナノ学会　第１１回大会
- Place of Presentation
  東京工業大学　百年記念館
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] 川添良幸第一原理計算による新規有機水素貯蔵材料の評価2013
- Author(s)
  水関博志、N. S. Venkataramanan、佐原亮二
- Organizer
  ナノ学会第11回大会
- Place of Presentation
  東京工業大学・百年記念館
- Data Source
  KAKENHI-PROJECT-24656575
[Presentation] Improved Design of Alkali-Doped Organic Materials for Hydrogen Storage2013
- Author(s)
  H. Mizuseki
- Organizer
  International Workshop on Computational Materials Design and Engineering (IWCMDE)
- Place of Presentation
  Jodhpur, India
- Invited
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] “Modeling on Adsorption Properties in Novel Hydrogen Storage Materials”2013
- Author(s)
  H. Mizuseki and Y. Kawazoe
- Organizer
  International Symposium on Nanostructures and Their Applications in Renewable Energy (ISNARE-2013)
- Place of Presentation
  Peking University,Beijing,China
- Invited
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] 分散処理とデータ処理技術を利用した分子設計システム2013
- Author(s)
  林　亮子，水関　博志
- Organizer
  情報処理学会MPS研究会第９６回
- Place of Presentation
  東京工業大学
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] ITと分子シミュレーションを用いた分子設計システム2013
- Author(s)
  林　亮子, 水関　博志
- Organizer
  ナノ学会第１１回大会
- Place of Presentation
  東京工業大学
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] Theoretical Study of Gas Storage Materials based on Clathrate Hydrate2013
- Author(s)
  H. Mizuseki, R. V. Belosludov, O. S Subbotin, V. Belosludov, and Y. Kawazoe
- Organizer
  MANA International Symposium 2013
- Place of Presentation
  Tsukuba, Japan
- Data Source
  KAKENHI-PROJECT-24656575
[Presentation] 第一原理計算による新規有機水素貯蔵材料の評価2013
- Author(s)
  水関博志、N. S. Venkataramanan、佐原亮二、川添良幸
- Organizer
  ナノ学会第１１回大会
- Place of Presentation
  東京工業大学・百年記念館
- Data Source
  KAKENHI-PROJECT-24656575
[Presentation] 粗放的シミュレーション実行に基づく分子設計支援システムの試み2013
- Author(s)
  林亮子, 水関博志
- Organizer
  第36回情報化学討論会
- Place of Presentation
  筑波大学, 茨城県つくば市
- Year and Date
  2013-11-08
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] First-principles Analysis of Hydrogen Storage Properties of Alkali-Doped Organic Materials2013
- Author(s)
  H. Mizuseki and Y. Kawazoe
- Organizer
  Asian Consortium on Computational Materials Science - Working Group Meeting on Computational Design of Materials for Energy Conversion and Storage
- Place of Presentation
  NTUST,Taipei, Taiwan
- Invited
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] IT と分子シミュレーションを用いた分子設計システム2013
- Author(s)
  林亮子, 水関博志
- Organizer
  ナノ学会第11回大会, 東京工業大学
- Place of Presentation
  東京都目黒区
- Year and Date
  2013-06-06
- Data Source
  KAKENHI-PROJECT-23500138
[Presentation] First Principles Investigation on Hydrogen Storage Phenomena2012
- Author(s)
  H. Mizuseki
- Organizer
  Advances in Quantum Chemistry: Interfacing Electronic Structure with Dynamics
- Place of Presentation
  University of Minnesota, Minneapolis, MN, U.S.A.
- Invited
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] First-principles Investigation of Hydrogen Storage Properties in Nanostructured Storage Materials2012
- Author(s)
  H. Mizuseki
- Organizer
  244th ACS National Meeting & Exposition
- Place of Presentation
  Philadelphia, PA, U.S.A.
- Invited
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] Effect of a nickel cluster on the dissociation process of hydrogen molecule2012
- Author(s)
  R. Sahara, H. Mizuseki, M. Sluiter, K. Ohno, and Y. Kawazoe
- Organizer
  International Symposium on Metal-Hydrogen Systems
- Place of Presentation
  京都
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] Introduction of TOMBO2012
- Author(s)
  R. Sahara, H. Mizuseki, M. Sluiter, K. Ohno, and Y. Kawazoe
- Organizer
  Asian Consortium on Computational Materials Science-Virtual Organization
- Place of Presentation
  東北大金研
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] 全電子混合基底法プログラムTOMBOによる水素貯蔵材料開発2012
- Author(s)
  佐原亮二、水関博志、Marcel Sluiter、大野かおる、川添良幸
- Organizer
  平成24年度　計算材料科学研究拠点(CMRI)　第一回シンポジウム
- Place of Presentation
  東北大金研
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] Development of all-electron mixed-basis ab initio program TOMBO and application for developing hydrogen storage materials2012
- Author(s)
  R. Sahara, H. Mizuseki, M. Sluiter, K. Ohno, and Y. Kawazoe
- Organizer
  244th ACS National Meeting & Exposition
- Place of Presentation
  Philadelphia
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] 全電子混合基底法プログラムTOMBOによる水素貯蔵材料の開発2012
- Author(s)
  佐原亮二、水関博志、Marcel Sluiter、大野かおる、川添良幸
- Organizer
  金属学会秋期大会
- Place of Presentation
  愛媛大学
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] First-Principles Investigation of Hydrogen Storage Properties on Metal-Doped Low-Dimensional Materials2012
- Author(s)
  H. Mizuseki
- Organizer
  NATO Advanced Research Workshop: Recent Trends in Energy Security With Special Emphasis on Low-Dimensional Functional Materials
- Place of Presentation
  Tashkent, Uzbekistan,
- Invited
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] 全電子混合基底法プログラムTOMBOによる水素分子の解離におけるニッケルダイマーの効果2012
- Author(s)
  佐原亮二、水関博志、Marcel Sluiter、大野かおる、川添良幸
- Organizer
  日本金属学会2012年春期大会
- Place of Presentation
  横浜国立大学
- Year and Date
  2012-03-29
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] 新規水素貯蔵材料のシミュレーション探索研究2011
- Author(s)
  水関博志、N.S.Venkataramanan、R.V.Belosludov、佐原亮二、陳剛、M.Khazaei、川添良幸
- Organizer
  日本金属学会2011年秋期大会
- Place of Presentation
  沖縄コンベンションセンター
- Year and Date
  2011-11-08
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] 第一原理計算によるアルカリ金属をドープした新規水素貯蔵材料の評価2011
- Author(s)
  水関博志、N.S.Venkataramanan、陳剛、佐原亮二、川添良幸
- Organizer
  ナノ学会第9回大会
- Place of Presentation
  北海道大学学術交流会館
- Year and Date
  2011-06-02
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] First-Principles Calculations on Hydrogen Storage Capacity2011
- Author(s)
  H.Mizuseki, N.S.Venkataramanan, R.Sahara, Y.Kawazoe
- Organizer
  MRS Spring 2011
- Place of Presentation
  West convention Center San Francisco, USA
- Year and Date
  2011-04-28
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] First-Principles Calculations on Transport Properties of Nanoscale Molecular Wires2011
- Author(s)
  H. Mizuseki, S. U. Lee, R. V. Belosludov, and Y. Kawazoe
- Organizer
  MRS Fall 2011
- Place of Presentation
  Boston, MA, U. S. A.
- Year and Date
  2011-11-28
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Theoretical Modeling of Phase Diagram of Clathrate Hydrates toward Hydrogen Storage Applications2011
- Author(s)
  R.V.Belosludov, H.Mizuseki, O.S.Subbotin, V.R.Belosludov, Y.Kawazoe
- Organizer
  TechConnect World 2011 (Clean Technology) Conference & Expo 2011
- Place of Presentation
  Boston, USA
- Year and Date
  2011-06-14
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] First-principles Study on Transport Properties of Nanoscale Conjugated Molecules2011
- Author(s)
  H.Mizuseki, Y.Kawazoe
- Organizer
  Asian Consortium on Computational Materials Science-Third Working Group Meeting (ACCMS-WGM3) on "Advances in Nano-device Simulation"
- Place of Presentation
  Jeju, Korea(Invited Talk)
- Year and Date
  2011-03-31
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] First Principles Investigation on Potential Hydrogen Storage Materials2011
- Author(s)
  H.Mizuseki, Y.Kawazoe
- Organizer
  The 6th Asian Consortium on Computational Materials Science (ACCMS-6)
- Place of Presentation
  National University of Singapore (NUS)シンガポール
- Year and Date
  2011-09-07
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] Theoretical Study of Hydrogen Storage Materials using All-electron Mixed-basis Program TOMBO2011
- Author(s)
  R.Sahara, H.Mizuseki, M.H.E.Sluiter, K.Ohno, Y.Kawazoe
- Organizer
  The 6th Asian Consortium on Computational Materials Science (ACCMS-6)
- Place of Presentation
  National University of Singapore (NUS)シンガポール
- Year and Date
  2011-09-09
- Data Source
  KAKENHI-PROJECT-23241027
[Presentation] First-principles Study on Transport Properties of Nanoscale Conjugated Molecules2011
- Author(s)
  H. Mizuseki and Y. Kawazoe (Invited)
- Organizer
  Asian Consortium on Computational Materials Science-Third Working Group Meeting
- Place of Presentation
  Jeju, Korea
- Year and Date
  2011-04-01
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] First-Principles Calculations on Transport Properties of Kanoscale Molecular Wires2011
- Author(s)
  H.Mizuseki, S.V.Lee, R.V.Belosludov, Y.Kawazoe
- Organizer
  MRS Fall 2011
- Place of Presentation
  Boston, MA, U.S.A.
- Year and Date
  2011-12-01
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Quantum Transport of Nanoscale Materials by using Ab Initio Calculations and Nonequilibrium Green's Function Formalism2010
- Author(s)
  H.Mizuseki, Y.Kawazoe
- Organizer
  Pacifichem2010
- Place of Presentation
  Honolulu, Hawaii, U.S.A
- Year and Date
  2010-12-16
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Quantum Conductance of Atomic and Molecular Bridges by Using First-principles Calculations and Nonequilibrium Green's Function Formalism2010
- Author(s)
  H. Mizuseki, S. U. Lee, R. V. Belosludov, and Y. Kawazoe
- Organizer
  MRS Fall 2010
- Place of Presentation
  Boston, MA, U. S. A.
- Year and Date
  2010-12-01
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Transport Properties of Molecular Wires by using First-principles Calculations and Nonequilibrium Green's Function Formalism2010
- Author(s)
  H.Mizuseki, S.-U.Lee, R.V.Belosludov, Y.Kawazoe
- Organizer
  MRS Spring meeting 2010
- Place of Presentation
  San Francisco, California USA
- Year and Date
  2010-04-06
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Quantum Transport of Nanoscale Materials by using Ab Initio Calculations and Nonequilibrium Green's Function Formalism2010
- Author(s)
  H. Mizuseki and Y. Kawazoe
- Organizer
  Pacifichem2010
- Place of Presentation
  Honolulu, Hawaii, U. S. A.
- Year and Date
  2010-12-15
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Transport Properties of Molecular Wires by using First-principles Calculations and Nonequilibrium Green's Function Formalism2010
- Author(s)
  H.Mizuseki, Y.Kawazoe
- Organizer
  MRS Workshop Nanocontacts and Nanointerconnects
- Place of Presentation
  San Francisco, California USA
- Year and Date
  2010-04-05
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Transport Properties of Molecular Wires by using First-principles Calculations and Nonequilibrium Green's Function Formalism2010
- Author(s)
  H. Mizuseki, S. U. Lee, R. V. Belosludov, and Y. Kawazoe
- Organizer
  MRS Spring 2010
- Place of Presentation
  San Francisco, California
- Year and Date
  2010-04-07
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Transport Properties of Nanostructures by using First-principles Calculations and Nonequilibrium Green's function Formalism2010
- Author(s)
  H. Mizuseki, S. U. Lee, R. V. Belosludov, H. Chen, and Y. Kawazoe
- Organizer
  Psi_k-2010 conference
- Place of Presentation
  Berlin, Germany
- Year and Date
  2010-09-14
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Transport Properties of Quantum Wires by First-Principles Calculations2009
- Author(s)
  H. Mizuseki (Invited)
- Organizer
  4th International Workshop on Surface Physics (IWSP2009)
- Place of Presentation
  L. dek-Zdroj, Poland
- Year and Date
  2009-09-22
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] Transport Properties of Quantum Wires by First-Principles Calculations2009
- Author(s)
  H.Mizuseki
- Organizer
  4th International Workshop on Surface Physics (IWSP2009)
- Place of Presentation
  Ladek-Zdroj, Poland
- Data Source
  KAKENHI-PROJECT-21310068
[Presentation] 起算材料科学のフロンティア : 新たな飛躍を目指して・水素エネルギー材料2009
- Author(s)
  水関博志
- Organizer
  金属学会平成21年度春季大会
- Place of Presentation
  東京都・千代田区
- Year and Date
  2009-03-28
- Data Source
  KAKENHI-PROJECT-18310067
[Presentation] 第一原理計算プログラムパッケージTOMBOを用いた水素吸蔵材料に対する全電子混合基底計算2008
- Author(s)
  水関博志
- Organizer
  第7回日本金属学会東北支部研究発表大会
- Place of Presentation
  宮城県・名取市
- Year and Date
  2008-11-29
- Data Source
  KAKENHI-PROJECT-18310067
[Presentation] 第三原理計算プログラムパッケージTOMBOを用いた水素久藏材料に対する全電子混合基底計算2008
- Author(s)
  水関博志
- Organizer
  第7回日本金属学会東北支部研究発表大会
- Place of Presentation
  宮城県・名取市
- Year and Date
  2008-11-29
- Data Source
  KAKENHI-PROJECT-18310067
[Presentation] Ab initio Calculations of Quantum Transport through Atomic and Molecular Wires2008
- Author(s)
  水関博志
- Organizer
  CECAM国際会議
- Place of Presentation
  フランス・リヨン
- Year and Date
  2008-06-11
- Data Source
  KAKENHI-PROJECT-18310067
[Presentation] Ab initio Calculations of Wuantum Transport through Atomic and Molecular Wires2008
- Author(s)
  水関博志
- Organizer
  CECAM国際会議、2008/06/11、フランス・リヨン
- Place of Presentation
  フランス・リヨン
- Year and Date
  2008-06-11
- Data Source
  KAKENHI-PROJECT-18310067
[Presentation] 全電子混合基底法プログラムTOMBOによる水素貯蔵材料設計
- Author(s)
  佐原亮二、水関博志、Marcel H. F. Sluiter、大野かおる、川添良幸
- Organizer
  ナノ学会第11回大会
- Place of Presentation
  東京工業大学
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] 全電子混合基底法プログラムTOMBOによる水素貯蔵材料開発
- Author(s)
  佐原亮二、水関博志、Marcel H. F. Sluiter、大野かおる、川添良幸
- Organizer
  ナノ学会第13回大会
- Place of Presentation
  東北大学
- Year and Date
  2015-05-11 – 2015-05-13
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] Development of hydrogen storage materials using TOMBO
- Author(s)
  R. Sahara, H. Mizuseki, Marcel H. F. Sluiter, K. Ohno, and Y. Kawazoe
- Organizer
  The 7th conference of the Asian Consortium on Computational Materials Science
- Place of Presentation
  タイ
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] Development of hydrogen storage materials using all electron mixed basis program TOMBO
- Author(s)
  R. Sahara, H. Mizuseki, Marcel H. F. Sluiter, K. Ohno, and Y. Kawazoe
- Organizer
  International Conference on Materials Engineering for Resources
- Place of Presentation
  秋田
- Invited
- Data Source
  KAKENHI-PROJECT-24560813
[Presentation] Effect of a nickel dimer on the dissociation dynamics of a hydrogen molecule
- Author(s)
  R. Sahara, H. Mizuseki, Marcel H. F. Sluiter, K. Ohno, and Y. Kawazoe
- Organizer
  20th Anniversary of TOMBO and Russian Megagrant Opening International Conference
- Place of Presentation
  東北大学
- Invited
- Data Source
  KAKENHI-PROJECT-24560813

1. KAWAZOE Yoshiyuki (30091672)

# of Collaborated Projects: 11 results

# of Collaborated Products: 75 results
2. BELOSLUDOV Rodion (10396517)

# of Collaborated Projects: 10 results

# of Collaborated Products: 31 results
3. SAHARA Ryoji (30323075)

# of Collaborated Projects: 9 results

# of Collaborated Products: 20 results
4. NISHIMATU Takeshi (70323095)

# of Collaborated Projects: 5 results

# of Collaborated Products: 0 results
5. MARCEL Sluiter (70292266)

# of Collaborated Projects: 3 results

# of Collaborated Products: 0 results
6. TAKAHASHI Masae (80183854)

# of Collaborated Projects: 2 results

# of Collaborated Products: 4 results
7. YU Jing zhi (10261512)

# of Collaborated Projects: 2 results

# of Collaborated Products: 4 results
8. INERBAEV Talgat (90431600)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
9. HONGOU Kenta (60405040)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
10. WENG Hngming (30447172)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
11. GORJIZADEH Narjes (90466574)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
12. HAYASHI Ryoko (30303332)

# of Collaborated Projects: 1 results

# of Collaborated Products: 11 results
13. HIRAI Toshio (50005865)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
14. WANG Xin ron (90301043)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
15. MASUMOTO Hiroshi (50209459)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
16. CHEN Li dong (90280883)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
17. WANG Qian (60292265)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
18. FUKUDA Tsugio (30199236)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
19. YOSHIKAWA Akira (50292264)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
20. SOMENO Yoshihiro

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
21. 菊池俊宏

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
22. 菊地俊宏

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
23. JAIN Amit

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results

MIZUSEKI Hiroshi 水関 博志

MIZUZEKI Hiroshi 水関 博志

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Gas Storage Materials by Ice at Ordinary Temperatures and PressuresPrincipal Investigator

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Evaluation and Survey of Electron Transport through Organic Molecules for Molecular DevicesPrincipal Investigator

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磁性人工格子を用いた多値記録手法による超高密度磁気記録材料への応用研究Principal Investigator

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MIZUSEKI Hiroshi 水関博志

MIZUZEKI Hiroshi 水関博志