| Ph. D. The University of Tokyo 1992/3 |
| Theoretical Chemistry of Condensed Phase Systems |
| Theoretical analysis of interactions in condensed phase systems and spectroscopic signals |
| Theoretical Chemistry, Physical Chemistry, Molecular Spectroscopy, Vibrational Spectroscopy, Solution Chemistry |
・The Chemical Society of Japan
[Note]2015年3月―2019年2月 TICディビジョン主査
・Japanese Molecular Liquids Group
[Note]2010年－2019年３月 チェアマン
・The American Physical Society
・Japan Association of Solution Chemistry
・The American Chemical Society
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| http://reve2.eng.shizuoka.ac.jp |
[1]. Relative importance of electrostatic and intermolecular charge-transfer interactions in halogen bonding depending on the properties analyzed
Phys. Chem. Chem. Phys. 27/36 19295-19303 (2025) [Refereed] refereed [Internationally co-authored papers] non-internationally co-authored paper
[Lead author or co-author] author
[Author] Kyosuke Ino and Hajime Torii [DOI]
[2]. Frequency shifts and noncoincidence effect of the CN stretching modes and the solvation structures of acetonitrile electrolyte solutions
J. Phys. Chem. B 129/28 7270-7281 (2025) [Refereed] refereed [Internationally co-authored papers] non-internationally co-authored paper
[Lead author or co-author] author
[Author] Miyu Hirose, Yukichi Kitamura, Hideaki Shirota, and Hajime Torii [DOI]
[3]. Single-sided delocalized polarization of the C60 cage and reduced infrared intensities and dipole moment of H2O@C60
J. Phys. Chem. A 128/50 10867-10874 (2024) [Refereed] refereed [Internationally co-authored papers] non-internationally co-authored paper
[Lead author or co-author] author
[Author] Hajime Torii, Shumpei Sadai, Yoshifumi Hashikawa, Yasujiro Murata, and Yuka Ikemoto [DOI]
[4]. Modeling of the hydrogen bond-induced frequency shifts of the HOH and HOD bending modes of water
J. Phys. Chem. A 128/26 5146-5157 (2024) [Refereed] refereed [Internationally co-authored papers] non-internationally co-authored paper
[Lead author or co-author] author
[Author] Hajime Torii and Tomoka Akazawa [DOI]
[5]. Roles of electrostatics and intermolecular electronic motions in the structural and spectroscopic features of hydrogen- and halogen-bonded systems
Pure Appl. Chem. 96/4 579-595 (2024) [Refereed] refereed [Internationally co-authored papers] non-internationally co-authored paper
[Lead author or co-author] author
[Author] Hajime Torii [DOI]
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[1]. Metal Ions and Complexes in Solution, Coordination Chemistry Fundamentals Series No. 2
Royal Society of Chemistry （2023）
[Book type]book(research)
[Sole author, co-author, or author and editor] contributor
[Author]Hajime Torii [Range] Vibrational Spectroscopy [REP page number] 62-77
[2]. Atoms, molecules and clusters in electric fields. Theoretical approaches to the calculation of electric polarizability
Imperial College Press （2006）
[Book type]book(research)
[Sole author, co-author, or author and editor] contributor
[Author]Hajime Torii [Range] Responses of molecular vibrations to intermolecular electrostatic interactions and their effects on vibrational spectroscopic features [REP page number] 179-214
[3]. Novel Approaches to the Structure and Dynamics of Liquids: Experiments, Theories and Simulations
Kluwer （2004）
[Book type]book(research)
[Sole author, co-author, or author and editor] contributor
[Author]Hajime Torii [Range] Computational methods for analyzing the intermolecular resonant vibrational interactions in liquids and the noncoincidence effect of vibrational spectra [REP page number] 343-360 |
[1]. Electrostatics and intermolecular electronic motions related to vibrational spectral features of hydrogen-bonded systems
22nd International Conference on Time Resolved Vibrational Spectroscopy (TRVS 2025) （2025/5/27） other
[Presenter]Hajime Torii
[2]. Elucidating the characteristics of halogen bonding through analyses of electron densities
8th JCS International Symposium on Theoretical Chemistry （2024/6/19） invited
[Presenter]Hajime Torii
[3]. 電子密度を参照することによる分子間相互作用と分子振動モード特性の解析
第17回分子科学討論会 （2023/9/14） invited
[Presenter]鳥居 肇
[4]. Roles of electrostatics and intermolecular electronic motions in the structural and spectroscopic features of hydrogen- and halogen-bonded systems
38th International Conference on Solution Chemistry (38ICSC) （2023/7/12） invited
[Presenter]Hajime Torii
[5]. Elucidating Electrostatic Characteristics of Halogen Bonding through Analyses of Electron Densities
5th International Symposium on Halogen Bonding (ISXB5) （2022/11/8） other
[Presenter]Hajime Torii
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[1]. joint (international) Analysis of nanometer-scale structures in condensed-phase systems using intermolecular resonant vibrational interactions
leader （ 2004/4 ）
[2]. joint (international) Analysis of nanometer-scale structures in condensed-phase systems using intermolecular resonant vibrational interactions
leader （ 2004/4 ）
[3]. joint (international) Noncoincidence effect of the vibrational spectra of liquids
leader （ 1996/1 ～ 2004/3 ） |
[1]. 電子密度変化に基づく分子間相互作用の画像解析法の基礎の確立と応用 （ 2023/4 ） Grant-in-Aid for Scientific Research (C) leader
[2]. 材料分子と水の界面において生ずるスペクトルの特徴的変化に関わる電子構造論的解析 （ 2023/4 ） Grant-in-Aid for Scientific Research on Innovative Areas (A) leader
[3]. 材料分子と水の界面において生ずるスペクトルの特徴的変化に関わる電子構造論的解析 （ 2022/4 ） Grant-in-Aid for Scientific Research on Innovative Areas (A) leader
[4]. 電子密度変化に基づく分子間相互作用の画像解析法の基礎の確立と応用 （ 2022/4 ） Grant-in-Aid for Scientific Research (C) leader
[5]. 電子密度変化の統計的解析に基づく水素結合系の静電分極モデルの生成法開発と応用 （ 2021/4 ） Grant-in-Aid for Scientific Research on Innovative Areas (A) leader
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[1]. 分子間の共鳴的振動相互作用を用いた凝縮相系におけるナノメータースケール構造の解析 （2004/4 ) [Offer orgnization] 日本学術振興会 [System name] 二国間交流事業オーストリアとの共同研究
[2]. 生体分子内色素分子の振動分極と光学的性質の制御 （2002/10 ) [Offer orgnization] 三菱化学研究奨励基金 [System name] 三菱化学研究奨励基金
[3]. 生体分子内色素分子の振動分極と光学的性質の制御 （2002/4 ) [Offer orgnization] 三菱化学研究奨励基金 [System name] 三菱化学研究奨励基金 |
[1]. （2005/8)
[Notes] 授与・助成団体名(公益信託分子科学研究奨励森野基金)
[2]. （2000/5)
[Notes] 授与・助成団体名(日本分光学会)
[3]. （1993/2)
[Notes] 授与・助成団体名(井上科学振興財団)
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[1]. アジア国際シンポジウム（理論化学・情報化学・計算化学） （2013/3)
[Role at conference, etc.] is leader [Site of conference, etc.] 草津市
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[1]. Journal of Raman Spectroscopy, Editorial Advisory Board member （2010/1 )
[2]. 分子シミュレーション研究会，会誌編集委員 （2009/1 - 2012/12 )
[3]. Bulletin of the Chemical Society of Japan, Associate Editor （2008/3 - 2012/12 )
[4]. International Conference on Time-Resolved Vibrational Spectroscopy, International Advisory Committee member （2008/1 )
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