Development & Application of Design Method for Electron-Transport Properties of Nanostructures

• Project/Area Number: 17064012
• Research Category: Grant-in-Aid for Scientific Research on Priority Areas
• Allocation Type: Single-year Grants
• Review Section: Science and Engineering
• Research Institution: Osaka University
• Principal Investigator: HIROSE Kikuji Osaka University, 大学院・工学研究科, 客員教授 (10073892)
• Co-Investigator(Kenkyū-buntansha): GOTO Hidekazu 大阪大学, 大学院・工学研究科, 准教授 (80170463) ; ONO Tomoya 大阪大学, 大学院・工学研究科, 助教 (80335372) ; INAGAKI Koji 大阪大学, 大学院・工学研究科, 助教 (50273579) ; EGAMI Yoshiyuki 長崎大学, 工学部, 助教 (20397631)
• Project Period (FY): 2005 – 2008
• Project Status: Completed (Fiscal Year 2008)
• Budget Amount: ¥41,200,000 (Direct Cost: ¥41,200,000); Fiscal Year 2008: ¥10,400,000 (Direct Cost: ¥10,400,000); Fiscal Year 2007: ¥10,400,000 (Direct Cost: ¥10,400,000); Fiscal Year 2006: ¥10,400,000 (Direct Cost: ¥10,400,000); Fiscal Year 2005: ¥10,000,000 (Direct Cost: ¥10,000,000)
• Keywords: 第一原理電子状態計算 / 電気伝導特性 / ナノストラクチャー

Research Abstract

本研究課題では、ナノメータースケールの微小構造体の構造や機能を原子・電子レベルで予測・解明することができる量子力学に基づいた計算手法とそれに基づいたシミュレーションプログラムを開発した。このようなスケールの構造体はマクロな構造体とは全く異なった性質を示すため、量子力学に基づいた解析が必須である。開発したプログラムを用いて原子や分子が一列に並んだ鎖の電気伝導特性や半導体デバイス用絶縁膜の絶縁特性などを解明する研究を行った。

Research Products

• [Journal Article] First-principles study on even-odd conductance oscillation of Pt atomic nanowires (2009)
  • Author(s): Tomoya Ono
  • Journal Title: The Journal of Physical Chemistry C 113(15) Pages: 6256-6260
  • Peer Reviewed
• [Journal Article] First-Principles Study on Magnetic Ordering of Al Infinite Single-row Atomic Wire (2009)
  • Author(s): Tadashi Ota, Kikuji. Hirose, and Tomoya Ono
  • Journal Title: J. Phys. : Condens. Matter 21 Pages: 64240-64240
  • Peer Reviewed
• [Journal Article] Total-energy minimization of few-body electron systems in the real-space finite-difference scheme (2009)
  • Author(s): Hidekazu Goto and Kikuji Hirose
  • Journal Title: J. Phys. : Condens. Matter 21 Pages: 64231-64231
  • Peer Reviewed
• [Journal Article] First-principles calculation of electronic polarization of III-V nanotubes (2008)
  • Author(s): Jun Otsuka, Kikuji Hirose, and Tomoya Ono
  • Journal Title: Phys. Rev. B. 78(3) Pages: 0354261-4
  • Peer Reviewed
• [Journal Article] Electron Transport Simulations of a Multilead System Using the Impulse Response Method (2008)
  • Author(s): T. Suzuki, H. Goto and K. Hirose
  • Journal Title: Surface and Interface Analysis 40 Pages: 1113-1116
  • Peer Reviewed
• [Journal Article] Path-Integral Renormalization Group Treatments for Many-Electron Systems with Long-Range Repulsive Interactions (2008)
  • Author(s): M. Kojo and K. Hirose
  • Journal Title: Surface and Interface Analysis 40 Pages: 1071-1074
  • Peer Reviewed
• [Journal Article] First-principles study on electronic structure of fullerene polymers (2008)
  • Author(s): H. Kitajima, Y. Egami, H Nakayama, K. Hirose and T. Ono
  • Journal Title: Surface and Interface Analysiss 40 Pages: 1063-1066
  • Peer Reviewed
• [Journal Article] First-principles study on STM current images of C2H2-adsorbed Si(001)surface (2008)
  • Author(s): Yoshiyuki Egami, Tomoya One and Kikuji Hirose
  • Journal Title: Surface and Interface Analysis 40 Pages: 1067-1070
  • Peer Reviewed
• [Journal Article] First-principles analysis of He and H atom incidence onto hydrogen-terminated Si(001)2AE surface (2008)
  • Author(s): Kouji Inagaki, Kikuji Hirose, Kiyoshi Yasutake
  • Journal Title: Surface and Interface Analysis 40 Pages: 1088-1091
  • Peer Reviewed
• [Journal Article] First-principles calculation of electronic polarization of III-V nanotubes (2008)
  • Author(s): Jun Otsuka, Kikuji Hirose, and Tomoya Ono
  • Journal Title: Phys. Rev B 78(3) Pages: 35426-35426
  • Peer Reviewed
• [Journal Article] First-Principles Study of Electron-Conduction Properties of C60 Bridges (2007)
  • Author(s): Tomoya Ono and Kikuji Hirose
  • Journal Title: Phys. Rev. Lett. 98(2) Pages: 0268041-4
  • Peer Reviewed
• [Journal Article] First-principles study on electronic structures and dielectric properties of Si/SiO_2 interface, Journal of Physics (2007)
  • Author(s): Tomoya Ono, Katsuhiro Kutsuki, Yoshiyuki Egami, Heiji Watanabe, and Kikuji Hirose
  • Journal Title: Condensed Matter 19(36) Pages: 3652021-7
  • Peer Reviewed
• [Journal Article] Relationship between Geometric Structure and Conductance Oscillation in Nanowires (2007)
  • Author(s): Yoshiyuki Egami, Shuichiro Aiba, Tomoya Ono, and Kikuji Hirose
  • Journal Title: Journal of Physics: Condensed Matter 19(36) Pages: 3652011-10
  • Peer Reviewed
• [Journal Article] A Path-Integration Calculation Method Based on the Real-Space Finite-Difference Scheme (2007)
  • Author(s): Hidekazu Goto, Tomoya Ono and Kikuji Hirose
  • Journal Title: Journal of Physics : Condensed Matter 19(36) Pages: 3652051-8
  • Peer Reviewed
• [Journal Article] Real-Space Density-Funcitonal Calculations for Transport Properties of Nanostructures (2007)
  • Author(s): Tomoya, Ono・Kikuji, Hirose
  • Journal Title: Journal of Computational and Theoretical Nanoscience 4(5) Pages: 840-859
  • Peer Reviewed
• [Journal Article] A Path-Integration Calculation Method Based on the Real-Space Finite-Difference Scheme (2007)
  • Author(s): Hidekazu, Goto・Tomoya, Ono・Kikuji, Hirose
  • Journal Title: Journal of Physics: Condensed Matter 19 Pages: 3652051-8
  • Peer Reviewed
• [Journal Article] Relationship between geometric structure and conductance oscillation in nanowires (2007)
  • Author(s): Yoshiyuki, Egami・Shuichiro, Aiba・Kikuji, Hirose・Tomoya, Ono
  • Journal Title: Journal of Physics: Condensed Matter 19 Pages: 3652011-10
  • Peer Reviewed
• [Journal Article] First-principles study on electronic structures and dielectric properties of Si/SiO_2 interface (2007)
  • Author(s): Tomoya, Ono・Katsuhiro, Kutsuki・Yoshiyuki, Egami・Heiji, Watanabe・Kikuji, Hirose
  • Journal Title: Journal of Physics: Condensed Matter 19 Pages: 3652021-7
  • Peer Reviewed
• [Journal Article] Electronic structures of peanut-shaped fullerene tubes (2007)
  • Author(s): Hiroyuki, Nakayama・Tomoya, Ono・Hidekazu, Goto・Kikuji, Hirose
  • Journal Title: Science and Technology of Advanced Materials 8 Pages: 196-199
  • Peer Reviewed
• [Journal Article] First-principles study of electronic structure of deformed carbon nanotube (2007)
  • Author(s): Kazuchika, Iwami・Hidekazu, Goto・Kikuji, Hirose・Tomoya, Ono
  • Journal Title: Science and Technology of Advanced Materials 8 Pages: 200-203
  • Peer Reviewed
• [Journal Article] First-principles study on electronic structures of Si/SiO_2 interface-effect of interface defects on local charge density- (2007)
  • Author(s): Katsuhiro, Kutsuki・Tomoya, Ono・Kikuji, Hirose
  • Journal Title: Science and Technology of Advanced Materials 8 Pages: 204-207
  • Peer Reviewed
• [Journal Article] First-Principles Calculation of Tunneling Current of H_2- or NH_3-Adsorbed Si(001) Surface in Scanning Tunneling Microscopy (2006)
  • Author(s): Shinya Horie, Tomoya Ono, Yuji Kuwahara, Katsuyoshi Endo, and Kikuji Hirose
  • Journal Title: Jpn. J. Appl. Phys. 45(3B) Pages: 2154-2157
  • Peer Reviewed
• [Journal Article] First-Principles Study on Electron-Conduction Properties of Single-Row Gold Nanowires (2006)
  • Author(s): Yoshiyuki Egami, Takashi Sasaki, Tomoya Ono, Hidekazu Goto, and Kikuji Hirose
  • Journal Title: Jpn. J. Appl. Phys. 45(3B) Pages: 2132-2135
  • Peer Reviewed
• [Journal Article] First-principles study of the tunnel current between a scanning tunneling microscopy tip and a hydrogen-adsorbed Si(001) surface (2006)
  • Author(s): Tomoya Ono, Shinya Horie, Katsuyoshi Endo, and Kikuji Hirose
  • Journal Title: Phys. Rev. B 73(24) Pages: 2453141-5
  • Peer Reviewed
• [Journal Article] Order-N first-principles calculation method for self-consistent ground-state electronic structures of semi-infinite systems (2006)
  • Author(s): Takashi Sasaki, Tomoya Ono, and Kikuji Hirose
  • Journal Title: Phys. Rev. E 74(5) Pages: 0657041-7
  • Peer Reviewed
• [Journal Article] First-principles study of leakage current through thin SiO_2 films (2006)
  • Author(s): Daisuke Nakagawa, Katsuhiro Kutsuki, Tomoya Ono, Kikuji Hirose
  • Journal Title: Physica B 376-377 Pages: 389-391
• [Journal Article] First-principles calculations of dielectric constants of C^<20> bulk using Wannier functions (2006)
  • Author(s): Jun Otsuka, Tomoya Ono, Kikuji Hirose
  • Journal Title: Physica B 376-377 Pages: 320-323
• [Journal Article] First-principles study of the tunnel current between a scanning tunneling microscopy tip and a hydrogen-adsorbed Si(001) surface (2006)
  • Author(s): Tomoya Ono, Shinya Horie, Katsuyoshi Endo, Kikuji Hirose
  • Journal Title: Phys. Rev. B 73・24 Pages: 2453141-5
• [Journal Article] Order-N first-principles calculation method for self-consistent ground-state electronic structures of semi-infinite systems (2006)
  • Author(s): Takashi Sasaki, Tomoya Ono, Kikuji Hirose
  • Journal Title: Phys. Rev. E 74・5 Pages: 0567041-7
• [Journal Article] First-Principles Study on Electron-Conduction Properties of C_<60> Chains (2006)
  • Author(s): Tomoya Ono, Kikuji Hirose
  • Journal Title: Phys. Rev. Lett. 98・02 Pages: 0268041-4
• [Journal Article] First-principles study of leakage current through thin SiO_2 films
  • Author(s): Daisuke Nakagawa, Katsuhiro Kutsuki, Tomoya Ono, Kikuji Hirose
  • Journal Title: Physica B (印刷中)
• [Journal Article] First-principles calculations of dielectric constants of C_<20> bulk using Wannier functions
  • Author(s): Jun Otsuka, Tomoya Ono, Kouji Inagaki, Kikuji Hirose
  • Journal Title: Physica B (印刷中)
• [Presentation] First-Principles Molecular-Dynamics Analysis of Sueface Reaction in Low-Temperature Si Thin Film Growth-Adsorption of Reactive Precursors onto H-Terminated Si Surface- (2009)
  • Author(s): K Inagaki, R. Kanai, K. Hirose, and K. Yasutake
  • Organizer: First International Symposium on Atomically Controlled Fabrication Technology Surface and Thin Film Processing, Osaka, February 16-17, 2009
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2009-02-16
• [Presentation] Path-Integral Renormalization Group Method for Accurate First-Principles Calculations of Coulombic Many-Body Systems (2009)
  • Author(s): M. Kojo and K. Hirose
  • Organizer: First International Symposium on. Atomically Controlled Fabrication Technology-Surface and Thin-Film Processing-, Osaka, February 16-17, 2009
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2009-02-16
• [Presentation] Total-Energy Minimization of Few-Body Electron Systems in the Real-Space Finite-Difference Scheme (2009)
  • Author(s): T. Yamashiki, K. Hirose and H. Goto
  • Organizer: First International Symposium on Atomically Controlled Fabrication Technology-Surface and Thin Film Processing-, Osaka, February 16-17, 2009
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2009-02-16
• [Presentation] First-principles Calculation for leakage Current through Si/SiO2 Interface (2009)
  • Author(s): Tomoya Ono
  • Organizer: XIV INTERNATIONAL WORKSHOP ON COMPUTATIONAL PHYSICS AND MATERIALS SCIENCE : TOTAL ENERGY AND FORCE METHODS ; January 8-10, 2009, Trieste, Italy
  • Place of Presentation: Trieste, Italy
  • Year and Date: 2009-01-09
• [Presentation] Path-Integral Renormalization Group Method for Multicomponent Coulombic Systems (2009)
  • Author(s): MsashiKoji and Kikuji Hirose
  • Organizer: XIV INTERNATIONAL WORKSHOP ON COMPUTATIONAL PHYSICS AND MATERIALS SCIENCE : TOTAL ENERGY AND FORCE METHODS, January 8-10, 2009, Trieste, Italy
  • Place of Presentation: Trieste, Italy
  • Year and Date: 2009-01-09
• [Presentation] Electronic and structural properties of germanium dioxide (2009)
  • Author(s): Shoichiro Saito, Kikuji Hirose and Tomoya Ono
  • Organizer: XIV INTERNATIONAL, WORKSHOP ON COMPUTATIONAL PHYSICS AND MATERIALS SCIENCE : TOTAL ENERGY AND FORCE METHODS, January 8-10, 2009, Trieste, Italy
  • Place of Presentation: Trieste, Italy
  • Year and Date: 2009-01-09
• [Presentation] Electronic and structural properties of germanium dioxide (2009)
  • Author(s): Shoichiro Saito, Kikuji Hirose, and Tomoya Ono
  • Organizer: XIV INTERNATIONAL WORKSHOP ON COMPUTATIONAL PHYSICS AND MATERIALS SCIENCE : TOTAL ENERGY AND FORCE METHODS
  • Place of Presentation: Trieste, Italy
• [Presentation] Path-Integral Renormalization Group Method for an Accurate First-Principles Calculation (2008)
  • Author(s): Masashi. Kojo
  • Organizer: GCOE International Workshop Quantum Simulations for Atomically Controlled Fabrication Technology, November 27, 2008, Grad. Schl. Eng. Osaka Univ
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2008-11-27
• [Presentation] Time evolving Self-Consistent calculation based on Real-Space Finite-Difference Method (2008)
  • Author(s): Kensuke Koyama, Kouji Inagaki, Kikuji Hirose, and Hidekazu Goto
  • Organizer: The 11th Asian Workshop On First-Principles Electronic Structure Calculations, November 3-5, 2008
  • Place of Presentation: Kaohsiung, Taiwan
  • Year and Date: 2008-11-01
• [Presentation] Total-energy minimization of few-body electron systems in the real-space finite-difference scheme (2008)
  • Author(s): Toru Yamashiki, Kikuji Hirose, and Hidekazu Goto
  • Organizer: The 11th Asian Workshop On First-Principles Electronic Structure Calculations, November 3-5, 2008
  • Place of Presentation: Kaohsiung, Taiwan
  • Year and Date: 2008-11-01
• [Presentation] Ab Initio Treatment of Multicomponent Systems within Path-Integral Renormalization Group Method (2008)
  • Author(s): Masashi Kojo and Kikuji Hirose
  • Organizer: The 11th Asian Workshop On First-Principles Electronic Structure Calculations, November 3-5, 2008
  • Place of Presentation: Kaohsiung, Taiwan
  • Year and Date: 2008-11-01
• [Presentation] First-Principles Study on Magnetic Ordering of Al Infinite Single-row Atomic Wire (2008)
  • Author(s): Tadashi Ota, Kikuji Hirose, and Tommoya Ono
  • Organizer: The 11th Asian Workshop On First-Principles Electronic Structure Calculations, November 3-5, 2008
  • Place of Presentation: Kaohsiung, Taiwan
  • Year and Date: 2008-11-01
• [Presentation] Oscillatory Behavior of Conductance of 5d Metal Nanowires (2008)
  • Author(s): Tomoya Ono
  • Organizer: The 11th Asian Workshop On First-Principles Electronic Structure Calculations, November 3-5, 2008
  • Place of Presentation: Kaohsiung, Taiwan
  • Year and Date: 2008-11-01
• [Presentation] Ab Initio Calculation of Atomic and Structures of Germanium Dioxide (2008)
  • Author(s): Shoichiro Saito, Kikuji Hirose and Tomoya Ono
  • Organizer: The 11th Asian Workshop On First-Principles Electronic Structure Calculations. November 3-5 2008
  • Place of Presentation: Kaohsiung, Taiwan
  • Year and Date: 2008-11-01
• [Presentation] Electron-Transport Simulations of Finite-Biased Jellium Nanowires by the Impulse-Response Method (2008)
  • Author(s): T. Suzuki, S. Aiba, K. Hirose and H. Goto
  • Organizer: 4th Handai Nanoscience and Nanotechnology International Symposium, September 29-October 1, 2008, Osaka, Japan
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2008-09-01
• [Presentation] First-principles electron-transport calculation for fullerene polymers (2008)
  • Author(s): H. Kitajima, K. Hirose and T. Ono
  • Organizer: 4th Handai Nanoscience and Nanotechnology International Symposium, September 29-October 1, 2008, Osaka, Japan
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2008-09-01
• [Presentation] First-principles study on electronic structure of germanium dioxide (2008)
  • Author(s): S. Saito, K. Hirose and T. Ono
  • Organizer: 4th Handai Nanoscience and Nanotechnology International Symposium, September 29-October 1, 2008, Osaka, Japan
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2008-09-01
• [Presentation] First-Principles Path-Integral Renormalization Group Method for Multicomponent Systems (2008)
  • Author(s): M. Kojo and K. Hirose
  • Organizer: 4th Handai Nanoscience and Nanotechnology International Symposium, September 29-October 1, 2008, Osaka, Japan
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2008-09-01
• [Presentation] First-principles study on electron transport properties of molecules (2008)
  • Author(s): Tomoya Ono
  • Organizer: 4th Handai Nanoscience and Nanotechnology International Symposium, September 29-October 1, 2008, Osaka, Japan
  • Place of Presentation: Osaka, Japan
  • Year and Date: 2008-09-01
• [Presentation] A Numerical Calculation Method for Electronic Structures of Few-Body Electronic Systems (2008)
  • Author(s): T. Yamashiki, S. Saito, K. Hirose and H Goto
  • Organizer: International Conference on Quantum Simulators and Design 2008, May 31-June 3, 2008
  • Place of Presentation: Tokyo, Japan
  • Year and Date: 2008-06-01
• [Presentation] Towards an efficient treatment of many-body terms in the transcorrelated method (2008)
  • Author(s): M. Kojo and K. Hirose
  • Organizer: International Conference on Quantum Simulators and Design 2008, May 31-June 3, 2008
  • Place of Presentation: Tokyo, Japan
  • Year and Date: 2008-06-01
• [Presentation] First-Principles Study on Electron-Conduction Properties of Fullerene Polymer Sheet (2008)
  • Author(s): H. Kitajima,Y. Egami, K.,Hirose and T. Ono
  • Organizer: International Conference On Quantum Simulators and Design 2008, May 31-June 3, 2008
  • Place of Presentation: Tokyo, Japan
  • Year and Date: 2008-06-01
• [Presentation] A Study on Electron Transport Properties of Nanostructures Using, the Impulse-Response Method (2008)
  • Author(s): T. Suzuki, K. Hirose, S. Aiba and H. Goto
  • Organizer: International Conference on Quantum Simulators and Design 2008, May 31-June 3, 2008
  • Place of Presentation: Tokyo, Japan
  • Year and Date: 2008-06-01
• [Presentation] First-Principles Study on Magnetic Ordering of Single-Row Al Wires using PAW Method (2008)
  • Author(s): T. Ota, T. Ono and K. Hirose
  • Organizer: International Conference on Quantum Simulators and Design 2008, May 31-June 3, 2008
  • Place of Presentation: Tokyo, Japan
  • Year and Date: 2008-06-01
• [Presentation] First-principles electron-transport property calculation for nanostructures suspended between semi-infinite electrodes (2008)
  • Author(s): Yoshiynki Egami, Tomoya Ono and Kikuii Hirose
  • Organizer: International Conference on Quantum Simulators and Design 2008, May 31-June 3, 2008
  • Place of Presentation: Tokyo, Japan
  • Year and Date: 2008-06-01
• [Presentation] The development of TDDFT Self-Consistent calculation program based on Real-Space Finite-Difference Method (2008)
  • Author(s): K. Koyama, K. Inagaki, K. Hirose and H. Goto
  • Organizer: International Conference on Quantum Simulators and Design 2008, May 31-June 3, 2008
  • Place of Presentation: Tokyo, Japan
  • Year and Date: 2008-06-01
• [Presentation] Conductance oscillation of 5d metal atomic nanowires (2008)
  • Author(s): Tomoya Ono
  • Organizer: International Conference on Quantum Simulators and Design 2008, May 31-June 3. 2008
  • Place of Presentation: Tokya, Japan
  • Year and Date: 2008-05-31
• [Presentation] First-principles electron-transport property calculation for nanostructures suspended between semiinfinite electrodes (2008)
  • Author(s): Yoshiyuki Egami, Tomoya Ono and Kikuji Hirose
  • Organizer: International Conference on Quantum Simulators and Design 2008
  • Place of Presentation: Tokyo, Japan
• [Presentation] First-principles study on electron transport properties of molecules (2008)
  • Author(s): Tomoya Ono
  • Organizer: 4th Handai Nanoscience and Nanotechnology International Symposium
  • Place of Presentation: Osaka, Japan
• [Presentation] First-principles electron-transport calculation for fullerene polymers (2008)
  • Author(s): Hideki Kitajima, Kikuji Hirose, and Tomoya Ono
  • Organizer: 4th Handai Nanoscience and Nanotechnology International Symposium
  • Place of Presentation: Osaka, Japan
• [Presentation] Oscillatory Behavior of Conductance of 5d Metal Nanowires (2008)
  • Author(s): Tomoya Ono
  • Organizer: The 11th Asian Workshop On First-Principles Electronic Structure Calculations
  • Place of Presentation: Kaohsiung, Taiwan
• [Presentation] First-principles study on quantum transport through thin films (2007)
  • Author(s): Tomoya, Ono・Kikuji, Hirose
  • Organizer: International Conference on Nanospintronic Design and Realization
  • Place of Presentation: Dresden, Germany
• [Presentation] First-principles study of electron transport through fullerene wires (2007)
  • Author(s): Tomoya, Ono・Kikuji, Hirose
  • Organizer: International Conference on Nano Science and Technology
  • Place of Presentation: Stockholm, Sweden
• [Presentation] Electron-Transport Calculation Based on Real-Space Method: Application For Fullerene Chains (2007)
  • Author(s): Tomoya, Ono・Kikuji, Hirose
  • Organizer: Twelfth International Conference on the Application of Density Functional Theory
  • Place of Presentation: Amsterdam, The Netherlands
• [Presentation] First-Principles Electron-Conduction Properties Calculation for Nanostructures (2007)
  • Author(s): Yoshiyuki, Egami・Tomoya, Ono・Kikuji, Hirose
  • Organizer: Twelfth International Conference on the Application of Density Functional Theory
  • Place of Presentation: Amsterdam, The Netherlands
• [Presentation] First-principles calculation for electron conduction properties using real-space finite-different method (2006)
  • Author(s): Tomoya Ono and Kikuji Hirose
  • Organizer: Quantum transport and non-adiabatic electron evolution from first principles approaches
  • Place of Presentation: Lyon, France
• [Presentation] Electronic Structures of Peanut-shaped Fullerene Tubes : Extended Abstracts of International (2006)
  • Author(s): Hiroyuki Nakayama, Tomoya Ono, Hidekazu Goto, and Kikuji Hirose
  • Organizer: 21st Century COE Symposium on Atomistic Fabrication Technology
  • Place of Presentation: Osaka, Japan
• [Presentation] Theoretical Calculations of Electron-Conduction Properties for Nanoscale Structures (2006)
  • Author(s): Kikuji Hirose and Tomoya Ono
  • Organizer: Handai Nanoscience and Nanotechnology International Symposium
  • Place of Presentation: Osaka, Japan
• [Book] 計算機マテリアルデザイン入門 (2005)
  • Author(s): 広瀬喜久治, 小野倫也 他
  • Total Pages: 397
  • Publisher: 大阪大学出版会
• [Patent(Industrial Property Rights)] Numerical Simulation Apparatus for Time Dependent Schrodinger Equation (2009)
  • Inventor(s): Kikuji HIROSE and Hidekazu GOTO
  • Industrial Property Rights Holder: Osaka University
  • Filing Date: 2009-03-12
  • Overseas
• [Patent(Industrial Property Rights)] 時間依存シュレディンガー方程式の数値シミュレーション装置 (2006)
  • Inventor(s): 広瀬喜久治、後藤英和
  • Industrial Property Rights Holder: 国立大学法人大阪大学
  • Industrial Property Number: 2006-247367
  • Filing Date: 2006-09-12
• [Patent(Industrial Property Rights)] 時間依存シュレディンガー方程式の数値シミュレーション装置 (2006)
  • Inventor(s): 広瀬喜久治, 後藤英和
  • Industrial Property Rights Holder: 国立大学法人大阪大学
  • Industrial Property Number: 2006-247367
  • Filing Date: 2006-09-12