Personnel Information


Ohta Katsuhisa

The master's program in charge

Division of Sustainable and Environmental Engineering

The doctoral program in charge

Division of Engineering

The department in charge

Department of Applied Sciences

Job title


Research field 【 display / non-display

  • Quantum Chemistry

Graduate school・Graduate course, etc. 【 display / non-display

  • Kyoto University

    1982,Doctoral program,Graduate School, Division of Engineering,石油化学専攻,Completed

Graduate school・major, etc. 【 display / non-display

  • Kyoto University

    1977,Faculty of Engineering,石油化学科,Graduate

Academic Society 【 display / non-display

  • The Physical Society of Japan

  • The Chemical Society


Books 【 display / non-display

  • Recent Research Developments in Quantum Chemistry

    K.Ohta,Transworld Research Network,Pathanalysis of electron transfer reactions. Electronic flux and canonical collective coordinates,(p.141),2000

  • New Horizons of Quantum Chemistry

    K.Morokuma ・ S.Kato ・ K.Kitaura ・ S.Obara ・ K.Ohta ・ H.Hanamura,Reidel,Potential energy surface of chemical reactions,1983

Papers 【 display / non-display

  • Constraints in the variational principle for stationary states

    Katsuhisa Ohta,Journal of Mathematical Chemistry,vol.56,(p.813 ~ 824),2018.03

  • Gauging away the electron-electron interaction by the local phase of complex wave functions in two-electron systems

    Katsuhisa Ohta ,Journal of Mathematical Chemistry,vol.55,(1),(p.98 ~ 104),2017.01

  • Application of pseudo-diabatic electronic states buried in Hartree-Fock wavefunctions to describe bond dissociation processes

    T. Murakami ・ K. Ohta,Computational and Theoretical Chemistry,vol.1065,(p.1 ~ 6),2015.08

  • Nonsingular constraints in time-dependent variational principle for parametrized wave functions

    Katsuhisa Ohta,International Journal of Quantum Chemistry,vol.113,(2),(p.161 ~ 170),2013.01

  • Intuitive Local Picture for Spin Polarization of Chemical Bonds

    K.Ohta ・ T.Sakai,International Journal of Quantum Chemistry,vol.110,(p.1172 ~ 1187),2009

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Presentaion at conference, meeting, etc. 【 display / non-display

  • カルボン酸二量体における分子間相互作用エネルギーの加成性


  • 複素波動関数の局所位相に由来するポテンシャルエネルギー

    粟津裕稀, 粟津裕稀,夏季研究発表会 ,日本化学会北海道支部 ,講演予稿集 ,(p.19-19),2017.07.22,旭川市

  • 化学反応における電子運動エネルギーの解析

    土田健斗, 太田勝久,夏季研究発表会 ,日本化学会北海道支部 ,講演予稿集 ,(p.18-18),2017.07.22,旭川市,日本

  • Constraints in TDVP


  • Local index of spin polarization of chemical bonds


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Class subject in charge 【 display / non-display

  • 分子分光学


  • 応用化学プレゼンテーション技法バイオシステムプレゼンテーション技法


  • 量子化学


  • 基礎化学


  • 分子科学特論

    2018,Master's program

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