OSHIYAMA ATSUSHI 押山淳

… Alternative Names

Researcher Number	80143361
Other IDs
External Links
Affiliation (Current)	2018 : 名古屋大学, 未来材料・システム研究所, 特任教授
Affiliation (based on the past Project Information) *help	2018 : 名古屋大学, 未来材料・システム研究所, 特任教授 2010 – 2015 : The University of Tokyo, 工学(系)研究科(研究院), 教授 2012 : 東京大学, 工学系研究科, 教授 2007 – 2011 : 東京大学, 大学院・工学系研究科, 教授 2009 : 東京大学, 工学系研究科, 教授 … More
Review Section/Research Field	Principal Investigator Science and Engineering / Nanomaterials/Nanobioscience / Medium-sized Section 29:Applied condensed matter physics and related fields / 表面界面物性 Except Principal Investigator Science and Engineering / Thin film/Surface and interfacial physical properties / Medium-sized Section 21:Electrical and electronic engineering and related fields / Biological Sciences / 固体物性I(光物性・半導体・誘電体)
Keywords	Principal Investigator 密度汎関数理論 / 量子論 / ナノ構造 / コンピューティクス / 計算科学 / 電子状態 / ナノ物質 / タンパク質 / 密度汎関数法 / 原子構造 … More Except Principal Investigator 第一原理計算 / 界面 / 欠陥 / 理論 / 電子励起 / 電子移動 / 半導体 / 量子効果 / ナノサイエンス / ナノ物性 / 半導体デバイス / III族窒化物半導体 / MOSトランジスタ / 将来デバイス / 不純物・欠陥 / ナノチューブ / 内包物質 / 量子シミュレーション / 酸化物 / GaN / ナノ界面 / AIN / 準安定構造 / ナノグラファイト / 緩和ダイナミックス / 非平衡物質 / 界面反応 / 荷電制御 / 内包構造 / structural change / 磁性 / non-equilibrium material / MBE / CL / 発光ダイナミックス / 非輻射再結合 / 炭素ナノチューブ / カーボンナノチューブ / タンパク質 / metastable structure / 計算機マテリアルデザイン / 水素 / defect reaction / AlN / 界面準位 / 原子移動 / 点欠陥 / 構造変化 / 金属基板 / 公開 / 欠陥反応 / Si / impurity defect / ナノデバイス / 絶縁体 / electronic excitation / 新材料 / 光学測定 / 化合物半導体 / 第一原理計算量子シミュレーション / InN / プロトン移動 / relaxation dynamics / 量子論 / SiC / 光吸収 / 物質反応デザイン / 原子操作 / 電子構造計算 / 陽電子消滅 / ヘム / シリコン / 金属 / 複合構造 / first-principle calculation / 単一光子光源 / ナノエレクトロニクス / チトクローム酸化酵素 / 電子状態 Less

Multi-scale calculations for complex correlation appearing in SiC oxidation and its impact on electronic propertiesOngoing
- Principal Investigator
  
  松下雄一郎
- Project Period (FY)
  2018 – 2020
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Review Section
  
  Medium-sized Section 21:Electrical and electronic engineering and related fields
- Research Institution
  Tokyo Institute of Technology
Clarification of interface formation and electronic properties of power semiconductors through quantum theoretical computicsPrincipal InvestigatorOngoing
- Principal Investigator
  
  押山淳
- Project Period (FY)
  2018 – 2021
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Review Section
  
  Medium-sized Section 29:Applied condensed matter physics and related fields
- Research Institution
  Nagoya University
Materials Design thorough Computics: Complex Correlation and Non-Equilibrium DynamicsPrincipal Investigator
- Principal Investigator
  
  OSHIYAMA Atsushi
- Project Period (FY)
  2010 – 2015
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Science and Engineering
- Research Institution
  The University of Tokyo
Density-Functional Approach to Atomic and Electronic Structures and their Dynamics in Nano-StructuresPrincipal Investigator
- Principal Investigator
  
  OSHIYAMA Atsushi
- Project Period (FY)
  2010 – 2014
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Science and Engineering
- Research Institution
  The University of Tokyo
Materials Design through Computics: Complex Correlation and Non-equilibrium DynamicsArea Organizer
- Area Organizer
  
  OSHIYAMA Atsushi
- Project Period (FY)
  2010 – 2014
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Research Institution
  The University of Tokyo
Design and study of nanotube hybrid structure
- Principal Investigator
  
  OKADA Susumu
- Project Period (FY)
  2007 – 2011
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  University of Tsukuba
Theoretical Design of Nano-Device and Nano-Interface by First Principles Approach
- Principal Investigator
  
  SHIRAISHI Kenji
- Project Period (FY)
  2006 – 2009
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  University of Tsukuba
Study of point defects and light-emitting dynamics in group-III nitride semiconductors
- Principal Investigator
  
  UEDONO Akira
- Project Period (FY)
  2006 – 2010
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  University of Tsukuba
New development of the theories of nano-interfaces and their application to nano-devices
- Principal Investigator
  
  SHIRAISHI Kenji
- Project Period (FY)
  2006 – 2008
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Thin film/Surface and interfacial physical properties
- Research Institution
  University of Tsukuba
チトクローム酸化酵素におけるプロトンポンプ機構の電子レベルでの解明
- Principal Investigator
  
  BOERO Mauro
- Project Period (FY)
  2005
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Biological Sciences
- Research Institution
  University of Tsukuba
Quantum Design of Shapes and Functions in Nano- and Bio-MaterialsPrincipal Investigator
- Principal Investigator
  
  OSHIYAMA Atsushi
- Project Period (FY)
  2005 – 2008
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  The University of Tokyo
  University of Tsukuba
Coordinate Group for Computational Real Materials Design
- Principal Investigator
  
  KASAI Hideaki
- Project Period (FY)
  2005 – 2008
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  Osaka University
Quantum Theory of Shapes and Properties in Nano-and Bio-Materials : Computational Physics ApproachPrincipal Investigator
- Principal Investigator
  
  OSHIYAMA Atsushi
- Project Period (FY)
  2004 – 2006
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Nanomaterials/Nanobioscience
- Research Institution
  University of Tsukuba
Quantum Theoretical Approach in Exploration of New Functions in Surface Nano-StructuresPrincipal Investigator
- Principal Investigator
  
  OSHIYAMA Atsushi
- Project Period (FY)
  2002 – 2003
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  表面界面物性
- Research Institution
  University of Tsukuba
荷電制御による原子操作
- Principal Investigator
  
  上浦洋一
- Project Period (FY)
  1999 – 2001
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas (B)
- Review Section
  
  Science and Engineering
- Research Institution
  Okayama University
Theoretical Study of Novel Structures of Materials by Electronic Excitation and Unified Model
- Principal Investigator
  
  SHINOZUKA Yuzo
- Project Period (FY)
  1995 – 1996
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Research Field
  
  固体物性I(光物性・半導体・誘電体)
- Research Institution
  Yamaguchi University

All 2016 2015 2014 2013 2012 2011 2010 2009 2008 2007 2006 2005 2004 Other

All Journal Article Presentation Book

[Book] Ｃａｒ－Ｐａｒｒｉｎｅｌｌｏ　Ｍｏｌｅｃｕｌａｒ　Ｄｙｎａｍｉｃｓ　（Encyclopedia of Nanotechnology）2015
- Author(s)
  B. Mauro and A. Oshiyama
- Total Pages
  10
- Publisher
  Ｓｐｒｉｎｇｅｒ
- Data Source
  KAKENHI-ORGANIZER-22104001
[Book] ポストシリコン半導体2013
- Author(s)
  押山淳　分担執筆：「結晶性半導体エピタキシャル成長の量子論」
- Total Pages
  510
- Publisher
  株式会社エヌ・ティー・エス
- Data Source
  KAKENHI-PLANNED-22104005
[Book] コンピューティクスによる物質デザイン：複合相関と非平衡ダイナミクス　平成２４年度報告書2013
- Author(s)
  押山淳　他
- Total Pages
  150
- Publisher
  自費
- Data Source
  KAKENHI-ORGANIZER-22104001
[Book] 岩波講座【計算科学】計算と物質2012
- Author(s)
  押山淳
- Total Pages
  292
- Publisher
  岩波書店
- Data Source
  KAKENHI-PLANNED-22104005
[Book] Magnetism in Nanometer-scale Materials that Contain No Magnetic Elements in Carbon Based Magnetism, edited by T. Makarova and F. Palacio2006
- Author(s)
  A.Oshiyama, S.Okada
- Total Pages
  18
- Publisher
  Elsevier
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Book] Magnetism in Nanometer-scale Materials that Contain No Magnetic Elements in Carbon Based Magnetism (edited by T.Makarova, F.Palacio)2006
- Author(s)
  A.Oshiyama, S.Okada
- Total Pages
  18
- Publisher
  Elsevier
- Data Source
  KAKENHI-PROJECT-17064002
[Book] Magnetism in Nanometer-scale Materials that Contain No Magnetic Elements in Carbon Based Magnetism, edited by T.Makarova and F.Palacio2005
- Author(s)
  A.Oshiyama, S.Okada
- Total Pages
  18
- Publisher
  Elsevier
- Data Source
  KAKENHI-PROJECT-16310083
[Book] Magnetism in Nanometer-scale Materials that Contain No Magnetic Elements in Carbon Based Magnetism(edited by T.Makarova, F.Palacio)2005
- Author(s)
  A.Oshiyama, S.Okada
- Publisher
  Elsevier
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Book] Magnetism in Nanometer-scale Materials that Contain No Magnetic Elements in Carbon Based Magnetism (edited by T.Makarova and F.Palacio)2005
- Author(s)
  A.Oshiyama, S.Okada
- Total Pages
  18
- Publisher
  Elsevier
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Density-Functional Study of Atomic and Electronic Structures of Multivacancies in Silicon Carbide2016
- Author(s)
  J.-I. Iwata, C. Shinei and A. Oshiyama
- Journal Title
  
  Physical Review B
  
  Volume : 93
- DOI
  10.1103/physrevb.93.125202
- Acknowledgement Compliant / Peer Reviewed
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] Electron doping through lithium intercalation to interstitial channels in tetrahedrally bonded SiC2015
- Author(s)
  Y. Sakai and A. Oshiyama
- Journal Title
  
  Journal of Applied Physics
  
  Volume : 118
- DOI
  10.1063/1.4934865
- Acknowledgement Compliant / Peer Reviewed
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] Crossover between silicene and ultra-thin Si atomic layers on Ag (111) surfaces2015
- Author(s)
  Z.-X. Guo and A. Oshiyama
- Journal Title
  
  New Journal of Physics
  
  Volume : 17
- DOI
  10.1088/1367-2630/17/4/045028
- Open Access / Acknowledgement Compliant / Peer Reviewed
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] Structural Stability and Energy-Gap Modulation through Atomic Protrusion in Freestanding Bilayer Silicene2015
- Author(s)
  Y. Sakai and A. Oshiyama
- Journal Title
  
  Physical Review B
  
  Volume : 91
- DOI
  10.1103/physrevb.91.201405
- Acknowledgement Compliant / Peer Reviewed
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] Energetics, Electron States, and Magnetization in Nearly Zigzag-Edged Graphene Nano-Ribbons2015
- Author(s)
  S. Suda and A. Oshiyama
- Journal Title
  
  Journal of the Physical Society of Japan
  
  Volume : 84 Pages : 024704-024704
- DOI
  10.7566/jpsj.84.024704
- Acknowledgement Compliant / Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005, KAKENHI-ORGANIZER-22104001
[Journal Article] Structural evolution and optoelectronic applications of multilayer silicene2015
- Author(s)
  Z.-X. Guo, Y.-Y. Zhang, H. Xiang, X.-G. Gong and A. Oshiyama
- Journal Title
  
  Physical Review B
  
  Volume : 92
- DOI
  10.1103/physrevb.92.201413
- Acknowledgement Compliant / Int'l Joint Research / Peer Reviewed
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] Density-Functional Study of Atomic and Electronic Structures of Multivacancies in Silicon Carbide2015
- Author(s)
  Y. Sugihara, K. Uchida and A. Oshiyama
- Journal Title
  
  Journal of the Physical Society of Janan
  
  Volume : 84
- Acknowledgement Compliant / Peer Reviewed
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] Origin of Repulsive Interactions between Bunched Steps on Vicinal Solid Surfaces2015
- Author(s)
  K. Sawada, J.-I. Iwata and A. Oshiyama
- Journal Title
  
  e-Journal of Surface Science and Nanotechnology
  
  Volume : 13 Pages : 231-234
- DOI
  10.1380/ejssnt.2015.231
- Open Access / Acknowledgement Compliant / Peer Reviewed
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] Large-Scale Real-Space Density-Functional Calculations: Moire-Induced Electron Localization in Graphene2015
- Author(s)
  A. Oshiyama, J.-I. Iwata, K. Uchida and Y. Matsushita
- Journal Title
  
  Journal of Applied Physics
  
  Volume : 117 Pages : 112811-112811
- DOI
  10.1063/1.4913837
- Acknowledgement Compliant / Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005, KAKENHI-ORGANIZER-22104001
[Journal Article] Atomic corrugation and electron localization due to Moire patterns in twisted bilayer graphenes2014
- Author(s)
  K. Uchida, S. Furuya, J.-I. Iwata and A. Oshiyama
- Journal Title
  
  Phys. Rev. B
  
  Volume : 90 Pages : 155451-155451
- DOI
  10.1103/physrevb.90.155451
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Surface energy of Si(110)- and 3C-SiC(111)-terminated surfaces2014
- Author(s)
  E. K. K. Abavare, I.-I. Iwata, A. Yaya and A. Oshiyama,
- Journal Title
  
  Phys. Status Solidi B
  
  Volume : 251 Pages : 1408-1415
- DOI
  10.1002/pssb.201350335
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Structural Tristability and Deep Dirac States in Bilayer Silicene on Ag(111) Surfaces2014
- Author(s)
  Z.-X. Guo and A. Oshiyama
- Journal Title
  
  Phys. Rev. B
  
  Volume : 89 Pages : 155418-155418
- DOI
  10.1103/physrevb.89.155418
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Diameter-Selective Alignment of Carbon Nanotubes on Si(001) Stepped Surfaces2014
- Author(s)
  B. Enkhtaivan, M. Yoshimura, J.-I. Iwata, and A. Oshiyama
- Journal Title
  
  J. Chem. Phys.
  
  Volume : 140 Pages : 44713-44713
- DOI
  10.1063/1.4862830
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Magic Angle and Height Quantization in Nanofacets on SiC(0001) Surfaces2014
- Author(s)
  K. Sawada, J.-I. Iwata adn A. Oshiyama
- Journal Title
  
  Appl. Phys. Lett.
  
  Volume : 104 Pages : 51605-51605
- DOI
  10.1063/1.4864295
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Electron Confinement due to Stacking Control of Atomic Layers in SiC Polytypes: Role of Floaing States and Spontaneous Polarization2014
- Author(s)
  Y.-i. Matsushita S. Furuya, and A. Oshiyama
- Journal Title
  
  J. Phys. Soc. Jpn.
  
  Volume : 83 Pages : 094713-094713
- DOI
  10.7566/jpsj.83.094713
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Interstitial Channels that Control Band Gaps and Effective Masses in Tetrahedrally Bonded Semiconductors2014
- Author(s)
  Y. Matsushita and A. Oshiyama
- Journal Title
  
  Phys. Rev. Lett.
  
  Volume : 112 Pages : 136403-136403
- DOI
  10.1103/physrevlett.112.136403
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Performance evaluation of ultra-large scale first-principles electronic structure calculation code on the K computer2013
- Author(s)
  Y. Hasegawa, J.-I. Iwata, M. Tsuji, D. Takahashi, A. Oshiyama, K. Minami, T. Boku, H. Inoue, Y. Kitazawa, I. Miyoshi, M. Yokokawa
- Journal Title
  
  The International Journal of High Performance Computing Applications
  
  Volume : online first version Oct 17 Pages : 508163-508163
- DOI
  10.1177/1094342013508163
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Absence and Presence of Dirac Electrons in Silicene on Substrates2013
- Author(s)
  Z.-X. Guo, S. Furuya, J.-I. Iwata and A. Oshiyama
- Journal Title
  
  Phys. Rev. B
  
  Volume : 87 Pages : 235435-235435
- DOI
  10.1103/physrevb.87.235435
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Firtst-Principles Study of Nanofacet Formation on 4H-SiC(0001) Surface2013
- Author(s)
  K. Sawada, J.-I. Iwata and A. Oshiyama
- Journal Title
  
  Proc. Int. Conf. Silicon Carbide and Related Materials (ICSCRM)
  
  Volume : 201 Pages : 778-780
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Atom-Scale Reaction Pathways and Free-Energy Landscapes in Oxygen Plasma Etching of Graphene2013
- Author(s)
  K. Koizumi, M. Boero, Y. Shigeta, and A. Oshiyama
- Journal Title
  
  Journal of Physical Chemistry Letters
  
  Volume : 4 Pages : 1592-1592
- DOI
  10.1021/jz400666h
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005, KAKENHI-PUBLICLY-25104716
[Journal Article] Atomic Reconstruction and Electron States at Interfaces between 3C-SiC(111) and Si(110)2013
- Author(s)
  E. K. K. Abavare, J.-I. Iwata and A. Oshiyama
- Journal Title
  
  Phys. Rev. B
  
  Volume : 87 Pages : 235321-235321
- DOI
  10.1103/physrevb.87.235321
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Large-Scale Electronic-Structure Calculations in the Real-Space Scheme: Bilayer Graphene and Silicene2013
- Author(s)
  K. Uchida, Z.-X. Guo, J.-I. Iwata and A. Oshiyama
- Journal Title
  
  Proc. JSAP-MRS Joint Symposia
  
  Volume : 1595 Pages : 1190-1190
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] New identification of Metallic Phases of In Atomic layers on Si(111) Surfaces2013
- Author(s)
  K. Uchida and A. Oshiyama
- Journal Title
  
  Phys. Rev. B
  
  Volume : 87 Pages : 165433-165433
- DOI
  10.1103/physrevb.87.165433
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Absence of Dirac Electrons in Silicene on Ag(111) Surfaces2013
- Author(s)
  Z.-X. Guo, S. Furuya, J.-I. Iwata and A. Oshiyama
- Journal Title
  
  J. Phys. Soc. Jpn.
  
  Volume : 82 Pages : 63714-63714
- DOI
  10.7566/jpsj.82.063714
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] コンピューティクスによる物質デザイン:複合相関と非平衡ダイナミクス平成23年度成果報告書2012
- Author(s)
  押山淳, 他
- Journal Title
  
  冊子形式
  
  Pages : 150-150
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] 第一原理に基づく物質計算の現状と展望2012
- Author(s)
  押山淳
- Journal Title
  
  日本シミュレーション学会誌
  
  Volume : 31 Pages : 11-11
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Structural stability and energy bands of Si nanowires along[110] direction2011
- Author(s)
  D.Sung, J.-I.Iwata, A.Oshiyama
- Journal Title
  
  Proc.30th Int.Conf.Physics on Semiconductors (Seoul, July 26-30, 2010).
  
  Volume : (印刷中)(掲載確定)
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Si Nanowire FET and Its Modeling2011
- Author(s)
  H.Iwai, K.Natori, K.Shiraishi, J.-I.Iwata, A.Oshiyama, K.Yamada, K.Ohmori, K.Kakushima, P.Ahmet
- Journal Title
  
  Science China
  
  Volume : 54 Pages : 1004-1011
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Selective Alignment fo Carbon Nanotubes on Supphire Surfaces : Bond Formation between Nanotubes and Substrates2011
- Author(s)
  S.Jeong, A.Oshiyama
- Journal Title
  
  Phys.Rev.Lett.
  
  Volume : 107 Pages : 65501-65501
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Self-diffusion in crystalline silicon : Car-Parrinello molecular dynamics study2011
- Author(s)
  K.Koizumi, M.Boero, Y.Shigeta, A.Oshiyama
- Journal Title
  
  Phys.Rev B
  
  Volume : 84 Pages : 205203-205203
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] コンピューティクスによる物質デザイン:複合相関と非平衡ダイナミクス平成22年度成果報告書2011
- Author(s)
  押山, 他
- Journal Title
  
  冊子形式
  
  Volume : 1 Pages : 78-78
- Data Source
  KAKENHI-ORGANIZER-22104001
[Journal Article] Large-Scale First-Principles Electronic Structure Calculations for Silicon Nanostructures2011
- Author(s)
  J.-I.Iwata, A.Oshiyama, K.Shiraishi
- Journal Title
  
  Proc.30th Int.Conf.Physics on Semiconductors (Seoul, July 26-30, 2010)
  
  Volume : (印刷中)(掲載確定)
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] First-principle Study of Energy-Band Control by Cross-Sectional Morphology in [110]-Si NanoWires2011
- Author(s)
  S.Kyogoku, J.-I.Iwata, A.Oshiyama
- Journal Title
  
  Proc.IEEE Int.Conf.Nanotechnology (Portland, August 2011)
  
  Pages : 1322-1326
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Comparative study of hybrid functionals applied to structural and electronic properties of semiconductors and insulators2011
- Author(s)
  Y.Matsushita, K.Nakamura, A.Oshiyama
- Journal Title
  
  Phys.Rev.B
  
  Volume : 84 Pages : 75205-75205
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] 磁性元素が関与しない磁性?界面・点欠陥の役割を予測2011
- Author(s)
  合田義弘, 押山淳, 常行真司
- Journal Title
  
  日本物理学会誌
  
  Volume : 66 Pages : 836-836
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Large-scale electronic-structurte calculations for nanomaterials in density functionl theory2011
- Author(s)
  A.Oshiyama, J.-I.Iwata
- Journal Title
  
  J.Phys : Conferenece Seris
  
  Volume : 302 Pages : 12030-12030
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Structure, spin, and charge of decavacancy V10 in crystalline silicon2011
- Author(s)
  K.Uchida, A.Oshiyama
- Journal Title
  
  Proc.30th Int.Conf.Physics on Semiconductros (Seoul, July 26-30, 2010)
  
  Volume : (印刷中)(掲載確定)
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] First-principles calculations of electron states of a silicon nanowire with 100,000 atoms on the K computer2011
- Author(s)
  Y.Hasegawa, J.-I.Iwata, M.Tsuji, D.Takahashi, A.Oshiyama, K.Minami, T.Boku, R.Shoji, A.Uno, M.Kurokawa, H, Inoue, I.Miyoshi, M.Yokokawa
- Journal Title
  
  Proceedings of 2011 International Conference for High Performance Computing, Networking, Storage and Analysis (ACM DIGITAL LIBRARY)
  
  Pages : 11-11
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] A massively-parallel electronic-structure calculations based on real-space density functional theory2010
- Author(s)
  J-I, Iwata, D. Takahashi, A. Oshiyama, T. Boku, K. Shiraishi, S. Okada, K. Yabana
- Journal Title
  
  J. Comp. Phys. 229
  
  Pages : 2339-2363
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18063003
[Journal Article] Atomic and Electronic Structures of α-Al2O3 Surfaces2010
- Author(s)
  T.Kurita, K.Uchida, A.Oshiyama
- Journal Title
  
  Phys.Rev.B
  
  Volume : 82
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22104005
[Journal Article] Electronic- structure calculations for carbonnanotube capacitor with a dielectric medium2009
- Author(s)
  K. Uchida and A. Oshiyama
- Journal Title
  
  Phys. Rev. B (in press)
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] First-Prinicple Study on In-related Nitride" Smiconductors2009
- Author(s)
  T. Obata, J.-I. Iwata, K. Shiraishi and A. Oshiyama
- Journal Title
  
  J. Cryst. Growth (印刷中)(掲載確定)
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Significant change in electronic structures of heme upon reduction by strong coulomb repulsion between Fe d electrons2009
- Author(s)
  K. Kamiya, S. Yamamoto, K. Shiraishi and A. Oshiyama
- Journal Title
  
  J. Phys. Chem. B 113
  
  Pages : 6886-6886
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] A Significant Change in Electronic Structures of Heme Upon Reduction by Strong Coulomb Repulsion between Fe $d$ Electrons2009
- Author(s)
  K. Kamiya, S. Yamamoto, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Journal of Physical Chemistry B (印刷中)(掲載確定)
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] First principles studies on In-related nitride semiconductors2009
- Author(s)
  T. Obata, J-I. Iwata, K. Shiraishi and A. Oshiyama
- Journal Title
  
  J. Cryst. Growth (印刷中)(掲載確定)
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Effects of Hydrogen-Bonding Environments on Protonation States around the Entrance of Proton Transfer Pathways in Cytochrome c Oxidase, AIP conference proceedings "Theory and Application of Computational Chemistry"2009
- Author(s)
  K.Kamiya, Y. Shigeta, A. Oshiyama
- Journal Title
  
  AIP Conference Proceedings 1102
  
  Pages : 257-257
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Significant Change in Electronic Structures of Heme Upon Reduction by Strong Coulomb Repulsion between Fe d Electrons2009
- Author(s)
  K. Kamiya, S. Yamamoto, K. Shiraishi, A. Oshiyama
- Journal Title
  
  J. Phys. Chem. B 113
  
  Pages : 6866-6872
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18063003
[Journal Article] Intrinsic ferromagnetism due to cation vacancies in Gd-doped GaN : First-principles calculations2008
- Author(s)
  Y. Gohda and A. Oshiyama
- Journal Title
  
  Phys. Rev. B 78
  
  Pages : 161201-161201
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Intrinsic ferromagnetism due to cation vacancies in Gd-doped GaN : First-principles calculations2008
- Author(s)
  Y. Gohda and A. Oshiyama
- Journal Title
  
  Physical Review B 78
  
  Pages : 161201-161201
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] A new crystalline phase of four-fold coordinated silicon and gremanium2008
- Author(s)
  Y. Fujimoto, T. Koretsune, S. Saito, T. Miyake, and A. Oshiyama
- Journal Title
  
  New Journal of Physics 10
  
  Pages : 83001-83001
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] 'Chemical Controllability of Charge States of Nitrogen-Related Defects in HfO$_x$N$ y$ : First-Principles Calculations2008
- Author(s)
  N. Umezawa, K. Shiraishi, Y. Akasaka, A. Oshiyama, S. Inumiya, S. Miyazaki, K. Ohmori, T. Chikyow, T. Ohno_ K. Yamahe. Y. Nara.
- Journal Title
  
  Physical Review B 77
  
  Pages : 165130-165130
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Ge vacancies at Ge/Si interfaces : stress enhanced pairing distrotion2008
- Author(s)
  K. Takai, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Phys. Rev. B77
  
  Pages : 45308-45308
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Large-scale density-functional calculations on Si divacancies2008
- Author(s)
  J. -I. Iwata, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Phys. Rev. B77
  
  Pages : 115208-115208
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Possible proton transfer mechanism through peptide groups in the H-pathway of the bovine cytochrome c oxidas2008
- Author(s)
  K. Kamiya, M. Boero, M. Tateno, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Biochimica et Biophysica Acta-Bioenergetics 1777
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Intrinsic ferromagnetism due to cation vacancies in Gd-doped GaN, "First principles simulation"2008
- Author(s)
  Y.Gohda, A.Oshiyama
- Journal Title
  
  Phys.Rev.B 78
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-18069001
[Journal Article] Large-scale density-functional calculations on silicon divacancies.2008
- Author(s)
  J. Iwata, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Physics Beview B77
  
  Pages : 115280-115280
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Ge vacancies at Ge/Si interfaces: Stress-enhanced pairing dist ortion2008
- Author(s)
  K., Takai・K., Shiraishi・A., Oshiyama
- Journal Title
  
  PHYSICAL REVIEW B 77
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18063003
[Journal Article] Ge Vacancies at Ge/Si Interfacee: Stress Enhanced Pairing Distrotion2008
- Author(s)
  K. Takai, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Physics Beview B77
  
  Pages : 45308-45308
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Generation of Acceptor Levels in Ge by the Uniaxial Strain-A Theoretical Approach-2008
- Author(s)
  K. Takai, K. Shiraishi and A. Oshiyama
- Journal Title
  
  ECS Trans 16
  
  Pages : 261-266
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Ge vacancies at Ge/Si interfaces: Stress-enhanced pairing distortion2008
- Author(s)
  K. Takai, K. Shiraishi, A. Oshiyama
- Journal Title
  
  PHYSICAL REVIEW B 77
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18360017
[Journal Article] Atomic and electronic structures of divacancy in carbon nanotubes2008
- Author(s)
  S. Berber and A. Oshiyama
- Journal Title
  
  Phys. Rev. B77
  
  Pages : 165405-165405
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Atomic and Electronic Structures of Divacancy in Carbon Nanotubes2008
- Author(s)
  S. Berber and A. Oshiyama
- Journal Title
  
  Physical Review B 77
  
  Pages : 165405-165405
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Chemical controllability of charge states of nitrogen-related defects in HfOxNy : First-principles calculations2008
- Author(s)
  N. Umezawa, K. Shiraishi, Y. Akasaka, A. Oshiyama, 他8名
- Journal Title
  
  Phys. Rev. B77
  
  Pages : 165130-165130
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Intrinsic ferromagnetism due to cation vacancies in Gd-doped GaN, "First principles simulation"2008
- Author(s)
  Y. Gohda and A. Oshiyama
- Journal Title
  
  Phys. Rev B 78
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-18069001
[Journal Article] Novel Mechanism for Proton Transfer in Bovine Cytochrome c Oxidase2007
- Author(s)
  K. Kamiya, M. Boero, M. Tateno, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Journal of Physics: Condensed Matter 19
  
  Pages : 365220-365220
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Quantum effects in a double-walled carbon nanotube capacitor2007
- Author(s)
  K. Uchida, S. Okada, K. Shiraishi, and A. Oshiyama
- Journal Title
  
  PHYSICAL REVIEW B 76(15) : Art. No. 155436 OCT
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18360017
[Journal Article] Possible mechanism of proton transfer through peptideg Groups in the H pathway of the Bovine Cytochrome c Oxidase2007
- Author(s)
  K. Kamiya, M. Boero, M. Tateno, K. Shiraishi and A. Oshiyama
- Journal Title
  
  J. Ame. Chem. Soc. 129
  
  Pages : 9663-9663
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Formation of Titanium-carbide in nanospace of C78 fullerenes2007
- Author(s)
  M.Otani, S.Okada, A, Oshiyama
- Journal Title
  
  Chemical Physics Letters 438
  
  Pages : 274-278
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19054002
[Journal Article] Quantum effects in double-walled carbon nanotube capacitor2007
- Author(s)
  K, Uchida, S. Okada, K. Shiraishi, and A. Oshiyama
- Journal Title
  
  Phys. Rev. B 76
  
  Pages : 155436-155436
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19054002
[Journal Article] Quantum effects in a double-walled carbon nanotube capacitor2007
- Author(s)
  K. Uchida, S. Okada, K. Shiraishi, A. Oshiyama
- Journal Title
  
  PHYSICAL REVIEW B 76(15)
  
  Pages : 155436-155436
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18063003
[Journal Article] Energetics of ice nanotubes and their encapsulation in carbon nanotubes from density-functional theory2007
- Author(s)
  T. Kurita, S. Okada, and A. Oshiyama
- Journal Title
  
  Physical Review B 75
  
  Pages : 205424-205424
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19054002
[Journal Article] Formation of titanium-carbide in a nanospace of C_<78>2007
- Author(s)
  M. Otani, S. Okada and A. Oshiyama
- Journal Title
  
  Chem. Phys. Lett. 438
  
  Pages : 274-274
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Quantum effects in a cylindrical carbon-nanotube capacito2007
- Author(s)
  K., Uchida・S., Okada・K., Shiraishi・A., Oshiyama
- Journal Title
  
  JOURNAL OF PHYSICS-CONDENSED MATTER 19
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18063003
[Journal Article] Possible Mechanism of Proton Transfer through Peptide Groups in the H-pathway of the Bovine Cytochrome c Oxidase2007
- Author(s)
  K. Kamiya, M. Boero, M. Tateno, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Journal of the American Chemical Society 129
  
  Pages : 9663-9673
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Energetics of Ice Nanotubes and their Encapsulation in Carbon. Nanotubes from Density-Functional Theory2007
- Author(s)
  T. Kurita, S. Okada, A. Oshiyama
- Journal Title
  
  Physics Review B75
  
  Pages : 205424-205424
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Quantum effects in a cylindrical carbon-nanotube capacitor2007
- Author(s)
  K. Uchida, S. Okada, K. Shiraishi, and A. Oshiyama
- Journal Title
  
  OURNAL OF PHYSICS-CONDENSED MATTER 19 (36) : Art. No. 365218
- Data Source
  KAKENHI-PROJECT-18063003
[Journal Article] Energetics of ice nanotubes and their encapsulation in carbon nanotubes from density- functional theory2007
- Author(s)
  T. Kurita, S. Okada and A. Oshiyama
- Journal Title
  
  Phys. Rev. B75
  
  Pages : 205424-205424
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Quantum effects in a double-walled carbon nanotube capacitor2007
- Author(s)
  K., Uchida・S., Okada・K., Shiraishi・A., Oshiyama
- Journal Title
  
  PHYSICAL REVIEW B 76
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18063003
[Journal Article] Quantum effects in double- walled carbon nanotubec capacitor2007
- Author(s)
  K. Uchida, S. Okada, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Phys. Rev. B76
  
  Pages : 155436-155436
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Quantum Effects in Cylindrical Carbon-Nanotube Capacitor2007
- Author(s)
  K. Uchida, S. Okada, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Journal of Physics: Condensed Matter 19
  
  Pages : 365218-365218
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Formation of titanium-carbide in a nanospace of C782007
- Author(s)
  M. Otani, S. Okada and A. Oshiyama
- Journal Title
  
  Chemical Physics Letters 438
  
  Pages : 274-274
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Quantum Effects in Double-Walled Carbon Nanotube Capacitor2007
- Author(s)
  K. Uchida, S. Okada, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Physics Beview B76
  
  Pages : 155436-155436
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Quantum effects in a double-walled carbon nanotube capacitor2007
- Author(s)
  K. Uchida, S. Okada, K. Shiraishi, and A. Oshiyama
- Journal Title
  
  PHYSICAL REVIEW B 76 (15) : Art. No. 155436
- Data Source
  KAKENHI-PROJECT-18063003
[Journal Article] Quantum effects in cylindrical carbon-nanotube capacitor2007
- Author(s)
  K, Uchida, S. Okada, K. Shiraishi, and A. Oshiyama
- Journal Title
  
  J. Phys.: Condensed Matter 19
  
  Pages : 365218-365218
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-19054002
[Journal Article] Enol-to-Keto Tautomerism of Peptide Groups2006
- Author(s)
  K.Kamiya, M.Boero, K.Shiraishi, A.Oshiyama
- Journal Title
  
  J.Phys.Chem B 110
  
  Pages : 4443-4450
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Real-space Density-functional Calculations for Si Divacancies with Large Size Supercell Models2006
- Author(s)
  J.-I.Iwata, A.Oshiyama, K.Shiraishi
- Journal Title
  
  Physica B (In press)
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Real-space Density-Functional Cal- culations for Si Divacancies with Large Size Supercell Models2006
- Author(s)
  J.-I.Iwata, A.Oshiyama, K.Shiraishi
- Journal Title
  
  Physica B 376-377
  
  Pages : 196-196
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Enol-to-Keto Tautomerism of Peptide Groups2006
- Author(s)
  K.Kamiya, M.Boero, K.Shiraishi, A.Oshiyama
- Journal Title
  
  J. Phys. Chem B 110
  
  Pages : 4443-4450
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Reconstruction of Mono-Vacancies in Carbon Nanotubes : Atomic Relaxation vs. Spin Polarization2006
- Author(s)
  S.Berber, A.Oshiyama
- Journal Title
  
  Physica B 376-377
  
  Pages : 272-272
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] First-principle Molecular Dynamics Study of Bond Disruption and Formation in SiO_2 upon Irradiation2006
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli, K.Murakami
- Journal Title
  
  Physica B 376-377
  
  Pages : 945-945
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Enhances Si and B diffusion in Smiconductir-Grade SiO_2 and the Effect of Strain on Diffusion2006
- Author(s)
  M.Uematsu, H.Kageshima, S.Fukatsu, K.M.Itoh, K.Shiraishi, M, Otani, A.Oshiyama
- Journal Title
  
  Thin Solid Films 508
  
  Pages : 270-270
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Enhanced Si and B diffusion in Semiconductor-Grade SiO_2 and the Effect of Strain on Diffusion2006
- Author(s)
  M.Uematsu, H.Kageshima, S.Fukatsu, K.M.Itoh, K.Shiraishi, M.Otani, A.Oshiyama
- Journal Title
  
  Thin Solid Films 508
  
  Pages : 270-270
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Atomic and Electronic Structures of Carbon Nanotubes on Si(001) Stepped Surfaces2006
- Author(s)
  S.Berber, A.Oshiyama
- Journal Title
  
  Phys. Rev. Lett 96
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Atomic and electronic structures of carbon nanotubes on Si(001) stepped surfaces2006
- Author(s)
  S. Berber and A. Oshiyama
- Journal Title
  
  Phys. Rev. Lett. 96
  
  Pages : 105505-105505
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Enol-to-Keto Tautomerism of Peptide Groups2006
- Author(s)
  K.Kamiya, M.Boero, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Journal of Physical Chemistry B 110
  
  Pages : 4433-4433
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Real-space Density-Functional Cal- culations for Si Divacancies with Large Size Supercell Models2006
- Author(s)
  J.-I.Iwata, A.Oshiyama, K.Shiraishi
- Journal Title
  
  Physica B 376-377
  
  Pages : 196-199
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Enhanced Si and B diffusion in Smiconductir-Grade SiO_2 and the Effect of Strain on Diffusion2006
- Author(s)
  M.Uematsu, H.Kageshima, S.Fukatsu, K.M.Itoh, K.Shiraishi, M.Otani, A.Oshiyama
- Journal Title
  
  Thin Solid Films 508
  
  Pages : 270-270
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Atomic and Electronic Structures of Carbon Nanotubes on Si(001) Stepped Surfaces2006
- Author(s)
  S.Berber, A.Oshiyama
- Journal Title
  
  Phys.Rev.Lett 96
  
  Pages : 105505-105505
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] First-principle Molecular Dynamics Study of Bond Disruption and Formation in SiO_2 upon Irradiation2006
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli, K.Murakami
- Journal Title
  
  Physica B 376-377
  
  Pages : 945-950
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Atomic and Electronic Structures of Carbon Nanotubes on Si(001) Stepped Surfaces2006
- Author(s)
  S.Berber, A.Oshiyama
- Journal Title
  
  Phys.Rev.Lett. (In press)
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Enol-to-keto Tautomerism of Peptide Groups2006
- Author(s)
  K.Kamiya, M.Boero, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Journal of Physical Chemistry B 110
  
  Pages : 4443-4443
- Data Source
  KAKENHI-PROJECT-17053002
[Journal Article] Reconstruction of mono-vacancies in carbon nanotubes : atomic relaxation vs. spin polarization2006
- Author(s)
  S.Berber, A.Oshiyama
- Journal Title
  
  Physica B (In press)
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Enhanced Si and B diffusion in Smiconductir-Grade SiO_2 and the Effect of Strain on Diffusion2006
- Author(s)
  M.Uematsu, H.Kageshima, S.Fukatsu, K.M.Itoh, K.Shiraishi, M.Otani, A.Oshiyama
- Journal Title
  
  Thin Solid Films 508
  
  Pages : 270-270
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Real-space Density-Functional Cal-culations for Si Divacancies with Large Size Super cell Models2006
- Author(s)
  J.I.Iwata, A.Oshiyama, K.Shiraishi
- Journal Title
  
  Physica B 376-377
  
  Pages : 196-196
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Reconstruction of Mono-Vacancies in Carbon Nanotubes : Atomic Relaxation vs. Spin Polarization2006
- Author(s)
  S.Berber, A.Oshiyama
- Journal Title
  
  Physica B 376-377
  
  Pages : 272-272
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Atomic and Electronic Structures of Carbon Nanotubes on Si(001) Stepped Surfaces2006
- Author(s)
  S.Berber, A.Oshiyama
- Journal Title
  
  Phys.Rev.Lett. (In press)
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Enol-to-keto tautomerism of peptide groups2006
- Author(s)
  K. Kamiya, M. Boero, K. Shiraishi and A. Oshiyama
- Journal Title
  
  J. Phys. Chem. B110
  
  Pages : 4443-4443
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Atomic and Electronic Structures of Carbon Nanotubes on Si(001) Stepped Surfaces2006
- Author(s)
  S.Berber, A.Oshiyama
- Journal Title
  
  Phys.Rev.Lett. 96
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Enol-to-Keto Tautomerism of Peptide Groups2006
- Author(s)
  K.Kamiya, M.Boero, K.Shiraishi, A.Oshiyama
- Journal Title
  
  J. Phys. Chem. B 110
  
  Pages : 4443-4443
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Enol-to-Keto Tautomerism of Peptide Groups2006
- Author(s)
  K.Kamiya, M.Boero, K.Shiraishi, A.Oshiyama
- Journal Title
  
  J.Phys.Chem.B 110
  
  Pages : 4443-4443
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] First-principle molecular dynamics study of bond disruption and formation in SiO_2 upon irradiation2006
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli, K.Murakami
- Journal Title
  
  Physica B (In press)
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] First-principle Molecular Dynamics Study of Bond Disruption and Formation in SiO2 upon Irradiation2006
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli, K.Murakami
- Journal Title
  
  Physica B
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Real-space Density-Functional Calculations for Si Deviancies with Large Size Supercell Models2006
- Author(s)
  J.-I.Iwata, A.Oshiyama, K.Shiraishi
- Journal Title
  
  Physica B
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Free Energy Molecular Dynamics Simulations of Pulsed-Laser-Irradiated SiO22005
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli, K.Murakami
- Journal Title
  
  Appl.Phys.Lett 86
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Free Energy Molecular Dynamics Simulations of Pulsed-Laser-Irradiated SiO_22005
- Author(s)
  M.Boero, A.Oshiyama, P.L.Sivestrelli, K.Murakami
- Journal Title
  
  Appl.Phys.Lett 86
  
  Pages : 201910-201910
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Double-Metal-Ion/Single-Metal-Ion Mechanisms of the Cleavage Reaction of Ribozymes2005
- Author(s)
  M.Boero, M.Tateno, K.Terakura, A.Oshiyama
- Journal Title
  
  J.Chem.Theory and Computation 1
  
  Pages : 925-925
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Electronic Structure of Semiconducting Nanotubes Adsorbed on Metal Surfaces2005
- Author(s)
  S.Okada, A.Oshiyama
- Journal Title
  
  Physical.Review.Letters 95
  
  Pages : 206804-206804
- Data Source
  KAKENHI-PROJECT-17053002
[Journal Article] New Electron States that Float on semiconductor and Metal Surface2005
- Author(s)
  S.Okada, Y.Enomoto, K Shiraishi, A.Oshiyama
- Journal Title
  
  Surface Science 585
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Free Energy Molecular Dynamics Simulations of Pulsed-Laser-Irradiated SiO_22005
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli, K.Murakami
- Journal Title
  
  Appl. Phys. Lett 86
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] New Electron States that Float on semiconductor and Metal Surface2005
- Author(s)
  S.Okada, Y.Enomoto, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Surface Science 585
- Data Source
  KAKENHI-PROJECT-17053002
[Journal Article] Carbon three-dimensional architecture formed by intersectional collision of graphite patches2005
- Author(s)
  T.Kawai, S.Okada, Y.Miyamoto, A.Oshiyama
- Journal Title
  
  Physical Review B 72
  
  Pages : 35428-35428
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Carbon three-dimensional architecture formed by intersectional collision of graphite patches2005
- Author(s)
  T.Kawai, S.Okada, Y.Miyamoto, A.Oshiyama
- Journal Title
  
  Physical.Review.B 72
  
  Pages : 35428-35428
- Data Source
  KAKENHI-PROJECT-17053002
[Journal Article] Double-Metal-Ion/single-Metal-Ion Mechanisms of the Cleavage Reaction of Ribozymes2005
- Author(s)
  M.Boero, M.Tateno, K.Terakura, A.Oshiyama
- Journal Title
  
  J.Chem.Theory and Computation 1
  
  Pages : 925-925
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Double-Metal-Ion/Single-Metal-Ion Mechanisms of the Cleavage Reaction of Ribozymes2005
- Author(s)
  M.Boero, M.Tateno, K.Terakura, A.Oshiyama
- Journal Title
  
  J. Chem. Theory and Computation 1
  
  Pages : 925-934
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Electronic Structure of Semiconducting Nanotubes Adsorbed on Metal Surfaces2005
- Author(s)
  S.Okada, A.Oshiyama
- Journal Title
  
  Physical Review Letters 95
  
  Pages : 206804-206804
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Electronic Structure of Semiconducting Nanotubes Adsorbed on Metal Surfaces2005
- Author(s)
  S.Okada, A.Oshiyama
- Journal Title
  
  Phys.Rev.Lett. 95
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] New Electron States that Float on semiconductor and Metal Surface2005
- Author(s)
  S.Okada, Y.Enomoto, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Surface Science 585
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] New electron states that float on semiconductor and metal surface2005
- Author(s)
  S. Okada, Y. Enomoto, K. Shiraishi and A. Oshiyama
- Journal Title
  
  Surf. Sci. 585
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Free Energy Molecular Dynamics Simulations of Pulsed-Laser-Irradiated SiO_22005
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli, K.Murakami
- Journal Title
  
  Applied Physic Letters 86
  
  Pages : 201910-201910
- Data Source
  KAKENHI-PROJECT-17053002
[Journal Article] Double-Metal-Ion/Single-Metal-Ion Mechanisms of the Cleavage Reaction of Ribozymes : First-Principles Molecular Dynamics Simulations of a Fully Hydrated Model System2005
- Author(s)
  M.Boero, M.Tateno, K.Terakura, A.Oshiyama
- Journal Title
  
  Journal of Chemical Theory and Computation 1
  
  Pages : 925-925
- Data Source
  KAKENHI-PROJECT-17053002
[Journal Article] Free Energy Molecular Dynamics Simulations of Pulsed-Laser-Irradiated SiO_22005
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli, K.Murakami
- Journal Title
  
  Appied Physics Letters 86
  
  Pages : 201910-201910
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] New Electron States that Float on semiconductor and Metal Surface2005
- Author(s)
  S.Okada, Y.Enomoto, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Surface Science 585
- Data Source
  KAKENHI-PROJECT-17064002
[Journal Article] Electronic Structure of Semiconducting Nanotubes Adsorbed on Metal Surfaces2005
- Author(s)
  S.Okada, A.Oshiyama
- Journal Title
  
  Phys. Rev. Lett. 95
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] New Electron States that Float on semiconductor and Metal Surface2005
- Author(s)
  S.Okada, Y.Enomoto, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Surf.Sci. 585
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Double-Metal-Ion/Single-Metal-Ion Mechanisms of the Cleavage Reaction of Ribozymes2005
- Author(s)
  M.Boero, M.Tateno, K.Terakura, A.Oshiyama
- Journal Title
  
  J.Chem.Theory and Computation 1
  
  Pages : 925-934
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] E'Centers in Silicon Dioxide : First Principles Molecular Dynamics Studies2004
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli
- Journal Title
  
  Mod.Phys.Lett. B18
  
  Pages : 707-707
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] E'Centers in Silicon Dioxide : First Principles Molecular Dynamics Studies2004
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrellip
- Journal Title
  
  Mod.Phys.Lett. B 18
  
  Pages : 707-707
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Electronic Structures of Stacked C60 Shuttlecocks2004
- Author(s)
  S.Okada, A.Oshiyama, R.Arita, H.Aoki
- Journal Title
  
  Chem.Phys.Lett. 399
  
  Pages : 157-169
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Density Functional Calculations and Eigenchannel Analyses for Electron Transport in Al and Si Atomic Wires2004
- Author(s)
  S.Okano, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Phys.Rev. B, 69
  
  Pages : 45401-45401
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Band Structures of Wurtzite InN and Ga{1-x}InxN by All-Electron GW Calculation2004
- Author(s)
  M.Usuda, N.Hamada, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Jpn.J.Appl.Phys. 43
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Electronic Structure of Polyglycine and Active sites of Cytochrome c Oxidase2004
- Author(s)
  K.Kamiya, K.Shiraishi, A.Oshiyama
- Journal Title
  
  J.Phys.Soc.Jpn 73
  
  Pages : 3198-3208
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Electronic Structures of Stacked C60 Shuttlecocks2004
- Author(s)
  S.Okada, R.Arita, Y.Matsuo, E.Nakamura, A.Oshiyama, H.Aoki
- Journal Title
  
  Chem. Phys. Lett. 399
  
  Pages : 157-169
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] A New Identification of C-Type Defects on Si(100) Surfaces2004
- Author(s)
  S.Okano, A.Oshiyama
- Journal Title
  
  Surface Science 554
  
  Pages : 272-279
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Band Structures of Wurtzite InN and Ga{1-x}InxN by All-Ele ctron GW Calculation2004
- Author(s)
  M.Usuda, N.Hamada, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Jpn. J. Appl. Phys. 43
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Electronic Structure of Polyglycine and Active sites of Cytochrome c Oxidase2004
- Author(s)
  K.Kamiya, K.Shiraishi, A.Oshiyama
- Journal Title
  
  J. Phys. Soc. Jpn 73
  
  Pages : 3198-3208
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Density Functional Calculations and Eigenchannel Analyses for Electron Transport in Al and Si Atomic Wires2004
- Author(s)
  S.Okano, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Phys.Rev.B 69
  
  Pages : 45401-45401
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Electronic Structures of Stacked C60 Shuttlecocks2004
- Author(s)
  S.Okada, R.Arita, Y.Matsuo, ENakarnura, A.Oshiyama, H.Aoki
- Journal Title
  
  Chem.Phys.Lett. 399
  
  Pages : 157-169
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] E'Centers in Silicon Dioxide : First Principles Molecular Dynamics Studies2004
- Author(s)
  M.Boero, A.Oshiyama, P.L.Silvestrelli
- Journal Title
  
  Mod. Phys. Lett. B 18
  
  Pages : 707-707
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Density Functional Calculations and Eigenchannel Analyses for Electron Transport in Al and Si Atomic Wires2004
- Author(s)
  S.Okano, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Phys. Rev. B 69
  
  Pages : 45401-45401
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Journal Article] Band Structures of Wurtzite InN and Ga{1-x}InxN by All-Electron GW Calculation
- Author(s)
  M.Usuda, N.Hamada, K.Shiraishi, A.Oshiyama
- Journal Title
  
  Jpn.J.Appl.Phys. 43
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-16310083
[Presentation] Interlayer interaction that is decisive in the ernegy gap of a few-layer phosphorene2016
- Author(s)
  Y. Sugihara, A. Oshiyama
- Organizer
  American Physical Society March Meeting
- Place of Presentation
  Baltimore Convention Center, USA
- Year and Date
  2016-03-16
- Int'l Joint Research
- Data Source
  KAKENHI-ORGANIZER-22104001
[Presentation] Multi-step atomic interchange mechanism for atom manipulation on semiconductor surface2016
- Author(s)
  B. Enkhtaivan, A. Oshiyama
- Organizer
  American Physical Society March Meeting
- Place of Presentation
  Baltimore Convention Center, USA
- Year and Date
  2016-03-16
- Int'l Joint Research
- Data Source
  KAKENHI-ORGANIZER-22104001
[Presentation] 4H-SiC(11-20)面酸化における初期O2吸着およびCO/CO2脱離反応経路の探索2016
- Author(s)
  李瀚、松下雄一郎、M. Boero、押山淳
- Organizer
  日本物理学会第17回年次大会
- Place of Presentation
  東北学院大学
- Year and Date
  2016-03-21
- Data Source
  KAKENHI-ORGANIZER-22104001
[Presentation] 密度汎関数理論によるSiC(0001)面上のグラフェン生成初期過程の微視的機構2016
- Author(s)
  井本文裕、岩田潤一、M. Boero、押山淳
- Organizer
  日本物理学会第17回年次大会
- Place of Presentation
  東北学院大学
- Year and Date
  2016-03-22
- Data Source
  KAKENHI-ORGANIZER-22104001
[Presentation] バンド・アンフォールディング法による捩れ二層グラフェンのフェルミ速度変調機構解明2016
- Author(s)
  西紘史、松下雄一郎、押山淳
- Organizer
  日本物理学会第17回年次大会
- Place of Presentation
  東北学院大学
- Year and Date
  2016-03-21
- Data Source
  KAKENHI-ORGANIZER-22104001
[Presentation] Electronic structures in SiC/SiO2 interface from first-principles calculation2016
- Author(s)
  Y. Matsushita, M. Boero, A.Oshiyama
- Organizer
  American Physical Society March Meeting
- Place of Presentation
  Baltimore Convention Center, USA
- Year and Date
  2016-03-15
- Int'l Joint Research
- Data Source
  KAKENHI-ORGANIZER-22104001
[Presentation] Band unfolding によるランダム固溶熱電材料のバンド構造の考察2015
- Author(s)
  桂ゆかり，岩田潤一，押山淳
- Organizer
  第12回日本熱電学会学術講演会
- Place of Presentation
  九州大学
- Year and Date
  2015-09-07
- Data Source
  KAKENHI-ORGANIZER-22104001
[Presentation] Large-Scale Electronic-Structure Calculations in the Real-Space Scheme: Bilayer Graphene and Silicene2013
- Author(s)
  4. A. Oshiyama
- Organizer
  2013 JSAP-MRS Joint Symposia
- Place of Presentation
  Doshisha University, Kyoto, Japan
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Large-Scale Calculations in the Real-Space Scheme: Absence and Presence of Dirac Electrons in Silicene2013
- Author(s)
  3. Z.-X. Guo, J.-I. Iwata and A. Oshiyama
- Organizer
  22th Int. Materials Research Congress (IMRC)
- Place of Presentation
  MRS, Cancun, Mexico
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Materials Design through Computics: Large-Scale Density-Functional Calculations for Nanomaterials in the Real-Space Scheme2013
- Author(s)
  1. A. Oshiyama
- Organizer
  Int. Summer School on HPC Challenges in Computational Sciences
- Place of Presentation
  New York University, New York City, USA
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Large-Scale Density-Functional Calculations in the Real-Space Scheme: Graphene and Silicene2013
- Author(s)
  2. A. Oshiyama
- Organizer
  7th Conf. Asian Consortium on Computational Materials Science (ACCMS7)
- Place of Presentation
  Suranaree University of Technology, Nakhon Ratchasima, Thailand
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Real-Space Density-Functional Approach to Electronic Properties of Nanostructures2012
- Author(s)
  A. Oshiyama
- Organizer
  Conference on Computaional Physics
- Place of Presentation
  Nichii Gakkan, Hyogo
- Year and Date
  2012-10-14
- Invited
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Materials Design through Computics: Nanostructures of Silicon and Carbon2012
- Author(s)
  A. Oshiyama
- Organizer
  10th Int. Meeting on High Peformance Computing for Computational Science (VECPAR2012)
- Place of Presentation
  RIKEN Advanced Institute for Computational Science (AICS), Hyogo
- Year and Date
  2012-07-17
- Invited
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] コンピューティクスによる物質デザイン:RSDFTを中心に2012
- Author(s)
  押山淳
- Organizer
  次世代ナノ統合シミュレーションソフトウェアの研究開発プロジェクト第6回公開シンポジウム
- Place of Presentation
  神戸ポートアイランドセンター
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Materials Design through Computics : nanowires and Nanotubes2011
- Author(s)
  A.Oshiyama
- Organizer
  International Focus Workshop on Quantum Simulations and Design
- Place of Presentation
  Dresden, Germany
- Year and Date
  2011-09-27
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Current Status of Density-Functional-Theory-Based Calculations for Nano- and Bio-Materials2011
- Author(s)
  A.Oshiyama
- Organizer
  Int.Sympo."Nanoscience and Quantum Physics 2011"
- Place of Presentation
  Tokyo国際文化会館
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] 励起ナノプロセス入門-第一原理計算2011
- Author(s)
  押山淳
- Organizer
  第48回応用物理学会スクール
- Place of Presentation
  山形大学
- Year and Date
  2011-08-29
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] PACS-CSにおける物性物理学研究2011
- Author(s)
  押山淳
- Organizer
  第2回「学際計算科学による新たな知の発見・統合・創出」シンポジウム
- Place of Presentation
  筑波大学
- Year and Date
  2011-09-01
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] コンピューティクスによる物質デザイン:RSDFTを例として2011
- Author(s)
  押山淳
- Organizer
  東京大学物性研究所計算物質科学研究センター第1回シンポジウム
- Place of Presentation
  東京大学
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Real-space density-functional-theory scheme and its application to large systems2009
- Author(s)
  A. Oshiyama
- Organizer
  Supercomputing in Solid State Physics
- Place of Presentation
  Kashiwa, Chiba
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Cation vacancies in nitride semiconductors: Possibility of intrinsic ferromagnetism2009
- Author(s)
  A. Oshiyama
- Organizer
  JST-DFG Workshop on Nanoelectronics
- Place of Presentation
  Kyoto
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Cation Vacancies in Nitride Semiconductors : A Possibility of Intrinsic Ferromagnetism2009
- Author(s)
  押山淳
- Organizer
  JST-DFG Workshop on Nanoelectronics
- Place of Presentation
  京都
- Year and Date
  2009-01-21
- Data Source
  KAKENHI-PLANNED-18069001
[Presentation] 蛋白質の立体構造・電子状態・生物機能の間の相関関係の研究2009
- Author(s)
  神谷克政、重田育照、マウロボエロ、白石賢二、押山淳
- Organizer
  第64回日本物理学会年次大会
- Place of Presentation
  立教大学
- Year and Date
  2009-03-28
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] ナノ構造体の面白さ - 電子論による機能探索2009
- Author(s)
  押山淳
- Organizer
  第56会応用物理学関係連合講演会シンポジウム
- Place of Presentation
  筑波大学
- Year and Date
  2009-03-30
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Screening of Electrostatic Field by Dielectric Carbonanotube2008
- Author(s)
  K. Uchida and A. Oshiyama
- Organizer
  1st Int Conf of The Grand Challenge Next-Generation Integrated Na
- Place of Presentation
  Tokyo
- Year and Date
  2008-06-04
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] 京速計算機を用いた物性第一原理計算とRSDFT超並列計算コードの開発2008
- Author(s)
  岩田潤一, 押山淳
- Organizer
  ハイパフォーマンスコンピューティングと計算科学(HPCS2008)
- Place of Presentation
  東京工業大学大岡山キャンパス
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] 窒化物半導体における陽イオン空孔による磁性2008
- Author(s)
  合田義弘、押山淳
- Organizer
  日本物理学会
- Place of Presentation
  岩手大学
- Year and Date
  2008-09-21
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Formation and Stability of Dislocation Cores in Ge/Si(001) Heterostructures2008
- Author(s)
  Y. Fujimoto and A. Oshiyama
- Organizer
  1st Int Conf of The Grand Challenge Next-Generation Integrated Na
- Place of Presentation
  Tokyo
- Year and Date
  2008-06-04
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] 窒化物半導体における陽イオン空孔による磁性2008
- Author(s)
  合田義弘,押山淳
- Organizer
  日本物理学会2008年秋季大会
- Place of Presentation
  岩手大学
- Year and Date
  2008-09-21
- Data Source
  KAKENHI-PLANNED-18069001
[Presentation] Multi-Walled Carbonnanotube Capacitor2008
- Author(s)
  K. Uchida and A. Oshiyama
- Organizer
  International Conference on Quantum Simulations and Design
- Place of Presentation
  Tokyo
- Year and Date
  2008-06-02
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Large-scale density-functional caculations using realspace parallelcomputation technique2008
- Author(s)
  A. Oshiyama
- Organizer
  1st Int. Conf. of The Grand Challenge to Next-Generation Integrated Nano science
- Place of Presentation
  Tokyo
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Structural and electronic properties of new crystalline phase of Si and Ge2008
- Author(s)
  Y. ujimoto, T. Korestune, S. Saito, T. Miyake, and A. Oshiyama
- Organizer
  International Conference on Quantum Simulatiors and Design
- Place of Presentation
  Tokyo
- Year and Date
  2008-06-02
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] シリコンとゲルマニウムの四配位新物質2008
- Author(s)
  藤本義隆、是常隆、三宅隆、斎藤晋、押山淳
- Organizer
  日本物理学会
- Place of Presentation
  岩手大学
- Year and Date
  2008-09-23
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] A novel proton transfer through peptide group in protein2008
- Author(s)
  K. Kamiya, Y. Shigeta, A. Oshiyama
- Organizer
  Theory and Application in Computational Chemistry
- Place of Presentation
  Shanghai
- Year and Date
  2008-09-24
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] 第一原理計算によるSi/Ge膜中の転位の原子・電子構造2008
- Author(s)
  藤本義隆、岩田潤一、押山淳
- Organizer
  日本物理学会
- Place of Presentation
  岩手大学
- Year and Date
  2008-09-23
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] 数nmサイズSi量子ドットの大規模第一原理計算2008
- Author(s)
  岩田潤一、白石賢二、押山淳
- Organizer
  日本物理学会
- Place of Presentation
  岩手大学
- Year and Date
  2008-09-21
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Large-scale Density-Functional Calculations using Real-Space Parallel-Computation Technique2008
- Author(s)
  A. Oshiyama
- Organizer
  lst Int. Cont. of The Urand Challenge to Next-Ueneration Integrated
- Place of Presentation
  Tokyo
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] ナノキャパシタの電気容量における静電遮蔽の効果2008
- Author(s)
  勾田和之、押山淳
- Organizer
  日本物理学会
- Place of Presentation
  岩手大学
- Year and Date
  2008-09-23
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Magnetism due to cation vacancies in group III nitrides2008
- Author(s)
  Y. Gohda and A. Oshiyama
- Organizer
  International Conference on Quantum Simulations and Design
- Place of Presentation
  Tokyo
- Year and Date
  2008-06-02
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Density-Functional Approach to Nano-and Bio-Materials2007
- Author(s)
  A, Oshiyama
- Organizer
  ICYS(NIMS)-ICMR(UC Santa Barbara)Summer School on Nanomaterials
- Place of Presentation
  NIMS,Tsukuba
- Year and Date
  2007-07-27
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Carbon nanotube and its hybrid structures2007
- Author(s)
  A. Oshiyama
- Organizer
  2nd Int. Sympo. on Nano meter-Scale Quantum Physics (nanoPHYS07)
- Place of Presentation
  Tokyo
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Microscopic mechanisms of proton transfer in cytochrome c oxidase : Car-Parrinello metadynamics approach2007
- Author(s)
  A. Oshiyama
- Organizer
  Handai Nanoscience and Nanotechnology Int. Sympo.
- Place of Presentation
  Osaka
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Proton Transfer in Cytochrome c Oxidase using CPMD+Metadynamics2007
- Author(s)
  A, Oshiyama
- Organizer
  Roberto Car 60th Birthday Symposium
- Place of Presentation
  ICTP,Trieste,Italy
- Year and Date
  2007-06-21
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Carbon Nanotube and its Hybrid Structures2007
- Author(s)
  A. Oshiyama
- Organizer
  2nd Int. Symposium on Nanometer-Scale Quantum Physics (nanoPHYS07)
- Place of Presentation
  Tokyo
- Data Source
  KAKENHI-PROJECT-18063003
[Presentation] Density-functional approach to nano- and bio-Materials2007
- Author(s)
  A. Oshiyama
- Organizer
  ICYS(NIMS)-IC MR (UC Santa Barbara) Summer School on Nanomaterials
- Place of Presentation
  Tsukuba
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Proton transfer in cytochrome c oxidase using CPMD+metadynamics2007
- Author(s)
  A. Oshiyama
- Organizer
  R. Car 60th Birthday Symposium
- Place of Presentation
  Trieste
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Current Stage of the Density Functional Approach Toward Atom Dynamics upon electron Excitation2007
- Author(s)
  押山淳
- Organizer
  日本物理学会2007年春季大会シンポジウム
- Place of Presentation
  鹿児島大学
- Year and Date
  2007-03-20
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Prediction of atomic and electronic structures of hybrid materials with carbon nanotubes2006
- Author(s)
  A. Oshiyama
- Organizer
  Int Workshop on Computational Challenges and Tools for Nanotubes
- Place of Presentation
  Nagano
- Year and Date
  2006-06-18
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Atomic and Electronic Structures of Carbon nanotubes on Si and Metal Surfaces2006
- Author(s)
  A. Oshiyama
- Organizer
  9th Asian Workshop on First-Principles Electronic-Structure Calculations
- Place of Presentation
  Seoul, KOREA
- Data Source
  KAKENHI-PROJECT-18063003
[Presentation] Atomic and Electronic Structures of Carbon nanotubes on Si and Metal Surfaces2006
- Author(s)
  A. Oshiyama
- Organizer
  9th Asian Workshop on First-Principles Electronic-Structure Calculations
- Place of Presentation
  Seoul
- Year and Date
  2006-11-06
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] ナノ・バイオ物質での密度汎関数法計算 : 現象の微視的機構と予測2006
- Author(s)
  押山淳
- Organizer
  ナノ学会第4回大会
- Place of Presentation
  京都大学
- Year and Date
  2006-05-20
- Data Source
  KAKENHI-PROJECT-17064002
[Presentation] Static and Dynamical Density-Functional Calculations for Nano-Materials: Moiré-Induced Electron Localization in Graphene and Laser-Triggered Crystallization in SiO2
- Author(s)
  A. Oshiyama
- Organizer
  MANA International Symposium 2015
- Place of Presentation
  Tsukuba（Tukuba,Ibaraki,Japan）
- Year and Date
  2015-03-11 – 2015-03-13
- Invited
- Data Source
  KAKENHI-PLANNED-22104005
[Presentation] Large-Scale Real-Space Density-Functional Calculations: Moiré-Induced Electron Localization in Graphene and Floating States in SiC
- Author(s)
  A. Oshiyama
- Organizer
  32nd International Conference on the Physics of Semiconductors
- Place of Presentation
  Austin, Texas, USA
- Year and Date
  2014-08-10 – 2014-08-15
- Invited
- Data Source
  KAKENHI-ORGANIZER-22104001

1. OKADA Susumu (70302388)

# of Collaborated Projects : 7results

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2. BOERO Mauro (40361315)

# of Collaborated Projects : 6results

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OSHIYAMA ATSUSHI 押山 淳

押山 淳 オシヤマ アツシ

OSHIYAMA Atsushi 押山 淳

Research Projects

Research Products

Co-Researchers

Multi-scale calculations for complex correlation appearing in SiC oxidation and its impact on electronic propertiesOngoing

Principal Investigator

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Clarification of interface formation and electronic properties of power semiconductors through quantum theoretical computicsPrincipal InvestigatorOngoing

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Materials Design thorough Computics: Complex Correlation and Non-Equilibrium DynamicsPrincipal Investigator

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Density-Functional Approach to Atomic and Electronic Structures and their Dynamics in Nano-StructuresPrincipal Investigator

Principal Investigator

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Materials Design through Computics: Complex Correlation and Non-equilibrium DynamicsArea Organizer

Area Organizer

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Quantum Design of Shapes and Functions in Nano- and Bio-MaterialsPrincipal Investigator

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Principal Investigator

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Review Section

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Quantum Theory of Shapes and Properties in Nano-and Bio-Materials : Computational Physics ApproachPrincipal Investigator

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Research Institution

Quantum Theoretical Approach in Exploration of New Functions in Surface Nano-StructuresPrincipal Investigator

Principal Investigator

Project Period (FY)

OSHIYAMA ATSUSHI 押山淳

押山淳オシヤマアツシ

OSHIYAMA Atsushi 押山淳

[Book] Ｃａｒ－Ｐａｒｒｉｎｅｌｌｏ　Ｍｏｌｅｃｕｌａｒ　Ｄｙｎａｍｉｃｓ　（Encyclopedia of Nanotechnology）2015

[Book] コンピューティクスによる物質デザイン：複合相関と非平衡ダイナミクス　平成２４年度報告書2013