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Novel Theory of Effective Many-Electron Systems based on the Density Functional Theory

Research Project

Project/Area Number 17064006
Research Category

Grant-in-Aid for Scientific Research on Priority Areas

Allocation TypeSingle-year Grants
Review Section Science and Engineering
Research InstitutionKansai University (2007-2008)
Osaka University (2005-2006)

Principal Investigator

SUZUKI Naoshi  Kansai University, システム理工学部, 教授 (40029559)

Co-Investigator(Kenkyū-buntansha) KUSAKABE Koichi  大阪大学, 大学院・基礎工学研究科, 准教授 (10262164)
HIGUCHI Masahiko  信州大学, 理学部, 准教授 (10292202)
HIGUCHI Katsuhiko  広島大学, 大学院・先端物質科学研究科, 准教授 (20325145)
Project Period (FY) 2005 – 2008
Project Status Completed (Fiscal Year 2008)
Budget Amount *help
¥26,000,000 (Direct Cost: ¥26,000,000)
Fiscal Year 2008: ¥7,300,000 (Direct Cost: ¥7,300,000)
Fiscal Year 2007: ¥7,300,000 (Direct Cost: ¥7,300,000)
Fiscal Year 2006: ¥7,300,000 (Direct Cost: ¥7,300,000)
Fiscal Year 2005: ¥4,100,000 (Direct Cost: ¥4,100,000)
Keywords密度汎関数理論 / 局所密度近似 / 電子相関 / 強相関電子系 / 高温超伝導体 / 有効多電子理論 / 拡張された制限つき探索理論 / 対密度汎関数理論 / 拡張された制限付き探索理論 / 高精度電子状態計算 / 負性有効電子間相互作用 / 交換・相関エネルギー / ヴィリアル法 / 電流密度汎関数理論 / Vorticity展開近似式 / 揺らぎ参照密度汎関数法 / ファンデルワールス密度汎関数法 / 密度汎関数法 / 電子状態 / 制限付き探索法 / 密度行列 / 有効電子模型 / ハートレー・フォック近似 / LDA+U法
Research Abstract

有効多電子系を定義する草部による多配置参照密度汎関数法に基づき、揺らぎ参照法による有効二体相互作用決定例を与え、さらに、参照系を必要としない密度汎関数変分理論を、モデル空間理論の形成により実現した。また、樋口(雅)・樋口(克)による「拡張された制限つき探索理論」に基づいて、電子相関をあらわに描写する有効理論「対密度汎関数理論」を構築するとともに、数値計算により、その有効性も実証した。

Report

(5 results)
  • 2008 Annual Research Report   Final Research Report ( PDF )
  • 2007 Annual Research Report
  • 2006 Annual Research Report
  • 2005 Annual Research Report
  • Research Products

    (89 results)

All 2009 2008 2007 2006 2005 Other

All Journal Article (58 results) (of which Peer Reviewed: 37 results) Presentation (19 results) Book (3 results) Patent(Industrial Property Rights) (9 results) (of which Overseas: 3 results)

  • [Journal Article] A quadratic form of the Coulomb operator and an optimization scheme for the extended Kohn-Sham models2009

    • Author(s)
      K. Kusakabe
    • Journal Title

      J. Phys.:Condens. Matter 21

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] Kinetic energy contribution to the exchange-correlation energy functional of the extended-constrained search theory2009

    • Author(s)
      K. Higuchi and M. Higuchi
    • Journal Title

      Phys. Rev. A 79

    • NAID

      120007114299

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] A quadratic form of the Coulomb operator and an optimization scheme for the extended Kohn-Sham models2009

    • Author(s)
      K. Kusakabe
    • Journal Title

      J. Phys. Condens. Matter 21(in press)

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A pair density functional theory utilizing the correlated wave function2009

    • Author(s)
      M. Higuchi
    • Journal Title

      J. Phys.: Conference Series 105

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Evaluation of the kinetic energy contribution to the exchange-correlation energy functional in the extended constrained-search theory : Application to the current density functional theory2009

    • Author(s)
      K. Higuchi
    • Journal Title

      J. Phys.: Conference Series 150

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Kinetic energy contribution to the exchange-correlation energy functional of the extended-constrained search theory2009

    • Author(s)
      K. Higuchi
    • Journal Title

      Phys. Rev. A 79

    • NAID

      120007114299

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Stacking-fault structure explains unusual elasticity of nanocrystalline diamonds2009

    • Author(s)
      H. Tanei
    • Journal Title

      Appl. Phys. Lett 94

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Computational scheme for the around-state pair density2009

    • Author(s)
      K. Higuchi
    • Journal Title

      J. Phys. Condens. Matter 21

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Theoretical evidences on enhanced superconducting transition temperature of CaSi2 in a high-pressure AlB2 phase2008

    • Author(s)
      A. Nakanishi, T. Ishikawa, H. Nagara, and K. Kusakabe
    • Journal Title

      J. Phys. Soc. Jpn 77

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] A pair density functional theory utilizing the noninteracting reference system : an effective initial theory2008

    • Author(s)
      M. Higuchi and K. Higuchi
    • Journal Title

      Phys. Rev. B 78

    • NAID

      120007114295

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] Theoretical evidences on enhanced superconducting transition temperature of CaSi_2 in a high-pressure AlB_2 phase2008

    • Author(s)
      A. Nakanishi
    • Journal Title

      J. Phys. Soc. Jpn 77

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] General Rule and Materials Design of Negative Effective U System for High-T_c Superconductivity2008

    • Author(s)
      H. Katayama-Yoshida
    • Journal Title

      Appl. Phys. Express 1

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A microscopic mechanism of Coulomb driven effective negative interaction for the high-temperature superconductivity2008

    • Author(s)
      K. Kusakabe
    • Journal Title

      J. Phys. Soc. Jpn 77suppl. C

      Pages: 109-112

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Two-Site Shift Product Wave Function Renormalization Group Method Applied to Quantum Systems2008

    • Author(s)
      H. Ueda
    • Journal Title

      J. Phys. Soc. Jpn 77

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Finite-size scaling of string order parameters characterizing the Haldane phase2008

    • Author(s)
      H. Ueda
    • Journal Title

      Phys. Rev. B 78

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Generation of Nano-Catalyst Particles by Spinodal Nano-Decomposition in Perovskite2008

    • Author(s)
      H. Kizaki
    • Journal Title

      Appl. Phys. Express 1

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Pair density functional theory utilizing the noninteracting reference system : An effective initial theory2008

    • Author(s)
      M. Higuchi
    • Journal Title

      Phys. Rev. B 78

    • NAID

      120007114295

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Scheme for calculating the orbital-dependent exchange-correlation potential using the virial theorem : Application to atomic systems2008

    • Author(s)
      M. Kodera
    • Journal Title

      Phys. Rev. A 78

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Consideration of the Effect of the Nonspherical Distribution of Electrons in Atomic Structures2008

    • Author(s)
      M. Miyashita
    • Journal Title

      Mater. Trans 49

      Pages: 1893-1899

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A new framework of the density functional theory2008

    • Author(s)
      K. Kusakabe
    • Journal Title

      Condensed Matter Theories 21(in press)

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Determination of the Mott insulating transition by the multi-reference density functional theory2007

    • Author(s)
      K. Kusakabe
    • Journal Title

      J. Phys.: Condens. Matter 19

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] A self-consistent first-principles calculation scheme for correlated electron systems2007

    • Author(s)
      K. Kusakabe, N. Suzuki, S. Yamanaka, and K. Yamaguchi
    • Journal Title

      J. Phys.: Condens. Matter 19

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] Evaluation of the vorticity expansion approximation of the CDFT by means of Levy's asymptotic bound2007

    • Author(s)
      M. Higuchi and K. Higuchi
    • Journal Title

      Phys. Rev. B 75

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] Pair density functional theory by means of the correlated wave function2007

    • Author(s)
      M. Higuchi and K. Higuchi
    • Journal Title

      Phys. Rev. A 75

    • NAID

      120000879776

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] A self-consistent first-principles calculation scheme for correlated electron systems2007

    • Author(s)
      K. Kusakabe, et. al.
    • Journal Title

      J. Phys. Condens. Matter 19

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Determination of the Mott insulating transition by the multi-reference density functional theory2007

    • Author(s)
      K. Kusakabe
    • Journal Title

      J. Phys. Condens. Matter 19

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Simultaneous equations for calculating the ground-state pair density2007

    • Author(s)
      M. Higuchi, et. al.
    • Journal Title

      J. Phys. Condens. Matter 19

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Evaluation of vorticity expansion approximation of current-density functional theory by means of Levy's asymptotic bound2007

    • Author(s)
      M. Higuchi, et. al.
    • Journal Title

      Phys. Rev. B 75

    • NAID

      120000879780

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Pair density-functional theory by means of the correlated wave function2007

    • Author(s)
      M. Higuchi, et. al.
    • Journal Title

      Phys. Rev. A 75

    • NAID

      120000879776

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] OEP Atomic-structure calculations with Moller-Plesset correlation and orbital polarization2007

    • Author(s)
      M. Kodera, et. al.
    • Journal Title

      J. Mag. & Mag. Mater. 310

      Pages: 1623-1625

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] New Practicable Forms for Exchange and Correlation Energy Functionals of the CDFT2007

    • Author(s)
      K. Higuchi, et. al.
    • Journal Title

      J. Mag. & Mag. Mater. 310

      Pages: 1065-1066

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Density functional scheme for calculating the ground-state pair density2007

    • Author(s)
      M. Higuchi, et. al.
    • Journal Title

      J. Mag. & Mag. Mater. 310

      Pages: 990-992

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A Proposal for Calculating the Orbital-Dependent Exchange-Correlation Potential by Means of the Virial Theorem2007

    • Author(s)
      M. Kodera, et. al.
    • Journal Title

      J. Phys. Soc. Jpn. 76

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Comparison between the vorticity expansion approximation and the local density approximation of the CDFT from the viewpoint of sum rules2007

    • Author(s)
      K. Higuchi, et. al.
    • Journal Title

      J. Phys. Condens. Matter 19

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A proposal of the approximate scheme for calculating the pair density2007

    • Author(s)
      M. Higuchi, et. al.
    • Journal Title

      Physica B 387

      Pages: 117-121

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A NEW FRAMEWORK OF THE DENSITY FUNCTIONAL THEORY2007

    • Author(s)
      K.Kusakabe
    • Journal Title

      Condensed Matter Theories 21

    • Related Report
      2006 Annual Research Report
  • [Journal Article] Determination of the U term by a density-density correlation function in the LDA+U Hamiltonian2007

    • Author(s)
      M.Takahashi, et al.
    • Journal Title

      Proc. 28th Int. Conf. Phys. Semicon. (Wien, 2008).

    • Related Report
      2006 Annual Research Report
  • [Journal Article] Modeling and Designing of Nano-Carbon Magnets by a Nev Density-Functional Theory2007

    • Author(s)
      K.Kusakabe, et al.
    • Journal Title

      Multifunctional Conducting Molecular Materials, (Edt. Gunji Saito et al.) (RSC Publishing)

      Pages: 232-236

    • Related Report
      2006 Annual Research Report
  • [Journal Article] A proposal of the approximate scheme for calculating the pair density2007

    • Author(s)
      M.Higuchi, K.Higuchi
    • Journal Title

      Physica B 387

      Pages: 117-121

    • Related Report
      2006 Annual Research Report
  • [Journal Article] A first-principles calculational method for the magnetic impurity problem based on a density-matrix functional theory2006

    • Author(s)
      K. Kusakabe, M. Takahashi, and N. Suzuki
    • Journal Title

      Physica B 378-380

      Pages: 271-272

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] Vorticity expansion approximation of the exchange and correlation energy functionals in current-density functional theory2006

    • Author(s)
      K. Higuchi and M. Higuchi
    • Journal Title

      Phys. Rev. B 74

    • NAID

      120000879774

    • Related Report
      2008 Final Research Report
    • Peer Reviewed
  • [Journal Article] A first-principles calculational method for the magnetic impurity problem based on a density-matrix functional theory2006

    • Author(s)
      K.Kusakabe, et al.
    • Journal Title

      Physica B 378-380

      Pages: 271-272

    • Related Report
      2006 Annual Research Report
  • [Journal Article] Expressions of energy and potential due to orbital polarization2006

    • Author(s)
      A.Narita, M.Higuchi
    • Journal Title

      J. Phys. Soc. Jpn. 75

    • NAID

      110004086869

    • Related Report
      2006 Annual Research Report
  • [Journal Article] Polynomial Representations of Unit Tensor Operators in fn and their Applications2006

    • Author(s)
      A.Narita, M.Higuchi
    • Journal Title

      J. Phys. Soc. Jpn. 75

    • Related Report
      2006 Annual Research Report
  • [Journal Article] Vorticity expansion approximation of the exchange and correlation energy functionals in current-density functional theory2006

    • Author(s)
      K.Higuchi, M.Higuchi
    • Journal Title

      Phys. Rev. B 74

    • NAID

      120000879774

    • Related Report
      2006 Annual Research Report
  • [Journal Article] Recent Development of Multireference Density Functional Theory2006

    • Author(s)
      S.Yamanaka
    • Journal Title

      Chemistry Letters 35

      Pages: 242-247

    • Related Report
      2005 Annual Research Report
  • [Journal Article] Exchange-correlation energy functional and virial theorem in the extended constrained-search theory2005

    • Author(s)
      K.Higuchi
    • Journal Title

      Phys.Rev.B 71

    • NAID

      120000879779

    • Related Report
      2005 Annual Research Report
  • [Journal Article] Extended constrained-search theory : Arbitrary choice of basic variables in density functional theory2005

    • Author(s)
      M.Higuchi
    • Journal Title

      CHIMIA 59

      Pages: 413-413

    • Related Report
      2005 Annual Research Report
  • [Journal Article] Virial and scaling relations for the exchange-correlation energy functional in the extended constrained-search theory2005

    • Author(s)
      K.Higuchi
    • Journal Title

      CHIMIA 59

      Pages: 419-419

    • Related Report
      2005 Annual Research Report
  • [Journal Article] Ab initio iterative CASCI-DFT approach2005

    • Author(s)
      S.Yamanaka
    • Journal Title

      CHIMIA 59

      Pages: 420-420

    • Related Report
      2005 Annual Research Report
  • [Journal Article] A first-principles many-body calculation based on a new density-matrix functional theory2005

    • Author(s)
      K.Kusakabe
    • Journal Title

      CHIMIA 59

      Pages: 422-422

    • Related Report
      2005 Annual Research Report
  • [Journal Article] A uniqueness theorem in a density-matrix functional theory2005

    • Author(s)
      K.Kusakabe
    • Journal Title

      cond-mat

    • Related Report
      2005 Annual Research Report
  • [Journal Article] MCSCF-DFT based on an interacting reference system2005

    • Author(s)
      S.Yamanaka
    • Journal Title

      physics

    • Related Report
      2005 Annual Research Report
  • [Journal Article] Determination of the Effective Spin Hamiltonian of Mn_6R_6 Referring to the Spin Density Functional Theory

    • Author(s)
      S.Tonooka, et al.
    • Journal Title

      Polyhedron (In press)

    • Related Report
      2006 Annual Research Report
  • [Journal Article] Oxygen at high pressures : theoretical approach to monoatomic phases

    • Author(s)
      T.Oda, et al.
    • Journal Title

      J. Phys. Condens. Matter. (In press)

    • Related Report
      2006 Annual Research Report
  • [Journal Article] A first-principles calculational method for the magnetic impurity problem based on a density-matrix functional theory

    • Author(s)
      K.Kusakabe
    • Journal Title

      Physica B (in press)

    • Related Report
      2005 Annual Research Report
  • [Journal Article] Modeling and Designing of Nano-Carbon Magnets by a New Density-Matrix Functional Theory

    • Author(s)
      K.Kusakabe
    • Journal Title

      Proc.Symp.#115 Area 8 PACIFICHEM (in press)

    • Related Report
      2005 Annual Research Report
  • [Journal Article] A New Framework of the Density Functional Theory

    • Author(s)
      K.Kusakabe
    • Journal Title

      Proc. Condensed Matter Theories (CMT29) (in press)

    • Related Report
      2005 Annual Research Report
  • [Presentation] Computational scheme for calculating the pair density2009

    • Author(s)
      Masahiko Higuchi
    • Organizer
      The second International Symposium and Workshop on Correlated Electrons in Matter
    • Place of Presentation
      Gatlinburg, USA
    • Year and Date
      2009-03-31
    • Related Report
      2008 Final Research Report
  • [Presentation] A series expansion of the Coulomb operator for optimization scheme of the multi-reference density functional theory2009

    • Author(s)
      Koichi Kusakabe
    • Organizer
      2009 APS March meeting
    • Place of Presentation
      USA
    • Year and Date
      2009-03-19
    • Related Report
      2008 Final Research Report
  • [Presentation] Computational pair density functional theory2008

    • Author(s)
      Masahiko Higuchi
    • Organizer
      The 11th Asian Workshop on First-Principles Electronicv Structure Calculations
    • Place of Presentation
      Kaohsiung, Taiwan
    • Year and Date
      2008-11-30
    • Related Report
      2008 Final Research Report
  • [Presentation] Computational pair density functional theory2008

    • Author(s)
      M. Higuchi
    • Organizer
      The 11th Asian Workshop on First-Principles Electronic Structure Calculations
    • Place of Presentation
      Kaohsiung, Taiwan
    • Year and Date
      2008-11-03
    • Related Report
      2008 Annual Research Report
  • [Presentation] Ab Initio Study on the Origin of the High Superconducting Transition Temperature in Calcium under High Pressure2008

    • Author(s)
      H. Nagara
    • Organizer
      46^<th> EHPRG Int. Conf
    • Place of Presentation
      Valencia, Spain
    • Year and Date
      2008-09-10
    • Related Report
      2008 Annual Research Report
  • [Presentation] Evaluation of the kinetic energy contribution to the exchange- correlation energy functional in the extended constrained-search theory : Application to the current density functional theory2008

    • Author(s)
      Katsuhiko Higuchi
    • Organizer
      25th international conference on Low Temperature Physics
    • Place of Presentation
      Amsterdam, Netherland
    • Year and Date
      2008-08-08
    • Related Report
      2008 Final Research Report
  • [Presentation] Analysis of Phonon Modes Strongly Coupled to Electrons in High Superconducting Transition Temperature Phases of Compressed Calcium2008

    • Author(s)
      N. Suzuki
    • Organizer
      25^<th> Int. Conf. on Low Temperature Physics [LT25]
    • Place of Presentation
      Amsterdam, Netherland
    • Year and Date
      2008-08-08
    • Related Report
      2008 Annual Research Report
  • [Presentation] A pair density functional theory utilizing the correlated wave function2008

    • Author(s)
      M. Higuchi
    • Organizer
      25^<th> Int. Conf. on Low Temperature Physics [LT25]
    • Place of Presentation
      Amsterdam, Netherland
    • Year and Date
      2008-08-08
    • Related Report
      2008 Annual Research Report
  • [Presentation] Evaluation of the kinetic energy contribution to the exchange-correlation energy functional in the extended constrained-search theory : Application to the current density functional theory2008

    • Author(s)
      K. Higuchi
    • Organizer
      25^<th> Int. Conf. on Low Temperature Physics [LT25]
    • Place of Presentation
      Amsterdam, Netherland
    • Year and Date
      2008-08-08
    • Related Report
      2008 Annual Research Report
  • [Presentation] Origin of the incommensurately modulated structure in phosphorus at high Pressures and the high pressure structures of calcium2008

    • Author(s)
      H. Nagara
    • Organizer
      Int. Conf. on Quantum Simulators and Design 2008 [QSD2008]
    • Place of Presentation
      Tokyo, Japan
    • Year and Date
      2008-06-01
    • Related Report
      2008 Annual Research Report
  • [Presentation] Computational scheme for the ground-state pair density2008

    • Author(s)
      K. Higuchi
    • Organizer
      Int. Conf. on Quantum Simulators and Design 2008 [QSD2008]
    • Place of Presentation
      Tokyo, Japan
    • Year and Date
      2008-06-01
    • Related Report
      2008 Annual Research Report
  • [Presentation] Atomic-structure calculations with orbital-dependent exchange potential satisfving the virial theorem2008

    • Author(s)
      M. Kodera
    • Organizer
      Int. Conf on Quantum Simulators and Design 2008 [QSD2008]
    • Place of Presentation
      Tokyo, Japan
    • Year and Date
      2008-06-01
    • Related Report
      2008 Annual Research Report
  • [Presentation] Atomic structure calculations with the effect of the nonspherical distribution of electrons taken into account2008

    • Author(s)
      M. Miyasita
    • Organizer
      Int. Conf. on Quantum Simulators and Design 2008 [QSD2008]
    • Place of Presentation
      Tokyo, Japan
    • Year and Date
      2008-06-01
    • Related Report
      2008 Annual Research Report
  • [Presentation] Pair Density Functional Theory by means of the Jastrow Wave Function2007

    • Author(s)
      M. Higuchi, et. al.
    • Organizer
      12th international Conference on the Applications of Density Functional Theory in Chemistry and Physics (DFT2007)
    • Place of Presentation
      Amsterdam, The Netherlands
    • Year and Date
      2007-08-27
    • Related Report
      2007 Annual Research Report
  • [Presentation] Vorticity Expansion Approximation of the Exchange-Correlation Energy Functional in Current-Density Functional Theory2007

    • Author(s)
      K. Higuchi, et. al.
    • Organizer
      12th international Conference on the Applications of Density Functional Theory in Chemistry and Physics (DFT2007)
    • Place of Presentation
      Amsterdam, The Netherlands
    • Year and Date
      2007-08-27
    • Related Report
      2007 Annual Research Report
  • [Presentation] Extended Constrained Search Theory and its Applications2007

    • Author(s)
      M. Higuchi, et. al.
    • Organizer
      ISSP International Workshop and Symposium on Foundations and Applications of the Density Functional Theory
    • Place of Presentation
      Tokyo, Japan
    • Year and Date
      2007-08-01
    • Related Report
      2007 Annual Research Report
  • [Presentation] Determination of the Mott insulating transition by the multi-reference density functional theory2007

    • Author(s)
      Koichi Kusakabe
    • Organizer
      International Conference on Strongly Correlated Electron Systems SCES'07
    • Place of Presentation
      Houston, USA
    • Year and Date
      2007-05-18
    • Related Report
      2008 Final Research Report
  • [Presentation] Determination of the Mott insulating transition by the multi-reference density functional theory2007

    • Author(s)
      K. Kusakabe
    • Organizer
      Int. Conf. Strongly Correlated Electron Systems, (SCES'07)
    • Place of Presentation
      Houston, USA
    • Year and Date
      2007-05-18
    • Related Report
      2007 Annual Research Report
  • [Presentation] A multi-reference DFT calculation for correlated electron systems using the fluctuation-reference method2006

    • Author(s)
      Koichi Kusakabe
    • Organizer
      International workshop on first-principles calculation of correlated electrons
    • Place of Presentation
      Tokyo
    • Year and Date
      2006-12-01
    • Related Report
      2008 Final Research Report
  • [Book] 「新しい密度汎関数法の基礎」,笠井秀明・赤井久純・吉田博編「計算機マテリアルデザイン入門」2005

    • Author(s)
      草部浩一
    • Publisher
      大阪大学出版会
    • Related Report
      2008 Final Research Report
  • [Book] 「相関電子系設計への指針」,笠井秀明・赤井久純・吉田博編「計算機マテリアルデザイン入門」2005

    • Author(s)
      草部浩一
    • Publisher
      大阪大学出版会
    • Related Report
      2008 Final Research Report
  • [Book] 計算機マテリアルデザイン入門,「新しい密度汎関数法の基礎」2005

    • Author(s)
      笠井秀明
    • Total Pages
      397
    • Publisher
      大阪大学出版会
    • Related Report
      2005 Annual Research Report
  • [Patent(Industrial Property Rights)] 電子状態計算法、電子状態計算装置、コンピュータプログラム、記録媒体2008

    • Inventor(s)
      草部浩一
    • Industrial Property Rights Holder
      大阪大学
    • Industrial Property Number
      2008-223813
    • Filing Date
      2008-09-01
    • Related Report
      2008 Final Research Report
  • [Patent(Industrial Property Rights)] 電界効果トランジスタ2008

    • Inventor(s)
      樋口克彦、福江直樹、樋口雅彦
    • Industrial Property Rights Holder
      広島大学、信州大学
    • Acquisition Date
      2008-11-14
    • Related Report
      2008 Final Research Report
  • [Patent(Industrial Property Rights)] 電流磁気効果を利用した超高速スイッチング素子2007

    • Inventor(s)
      樋口克彦、樋口雅彦
    • Industrial Property Rights Holder
      広島大学、信州大学
    • Industrial Property Number
      2006-212395
    • Filing Date
      2007-08-02
    • Related Report
      2008 Final Research Report
  • [Patent(Industrial Property Rights)] Current amplifying element and current amplification method2007

    • Inventor(s)
      K. Higuchi and M. Higuchi
    • Industrial Property Rights Holder
      Hiroshima University and Shinshu University
    • Filing Date
      2007-08-02
    • Related Report
      2008 Final Research Report
    • Overseas
  • [Patent(Industrial Property Rights)] Electronic state calculation method, electronic state calculation device, computer program, and recording medium2007

    • Inventor(s)
      Koichi Kusakabe
    • Industrial Property Rights Holder
      Osaka university
    • Filing Date
      2007-03-02
    • Related Report
      2008 Final Research Report
    • Overseas
  • [Patent(Industrial Property Rights)] 電流増幅素子2007

    • Inventor(s)
      樋口克彦、樋口雅彦
    • Industrial Property Rights Holder
      広島大学、信州大学
    • Filing Date
      2007-08-02
    • Related Report
      2007 Annual Research Report
    • Overseas
  • [Patent(Industrial Property Rights)] 電子状態計算法、電子状態計算装置、コンピュータプログラム、及び記録媒体2006

    • Inventor(s)
      草部浩一
    • Industrial Property Rights Holder
      大阪大学
    • Industrial Property Number
      2006-148978
    • Filing Date
      2006-05-29
    • Related Report
      2008 Final Research Report
  • [Patent(Industrial Property Rights)] 電子状態計算方法、電子状態計算装置、コンピュータプログラム、及び記録媒体2006

    • Inventor(s)
      草部浩一
    • Industrial Property Rights Holder
      大阪大学
    • Industrial Property Number
      2006-148978
    • Filing Date
      2006-05-29
    • Related Report
      2006 Annual Research Report
  • [Patent(Industrial Property Rights)] 電流増幅素子2006

    • Inventor(s)
      樋口克彦, 樋口雅彦
    • Industrial Property Rights Holder
      広島大学, 信州大学
    • Industrial Property Number
      2006-212395
    • Filing Date
      2006-08-03
    • Related Report
      2006 Annual Research Report

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Published: 2005-04-01   Modified: 2018-03-28  

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