Theoretical study of the complexes of dichlorobenzene isomers with argon. II. SAPT analysis of the intermolecular interaction

The Journal of Chemical Physics ◽

10.1063/1.5053802 ◽

2019 ◽

Vol 150 (7) ◽

pp. 074302 ◽

Author(s):

Leonid Shirkov ◽

Jan Makarewicz

Keyword(s):

Intermolecular Interaction ◽

Theoretical Study

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Theoretical Study on Near-Resonant Third-Order Nonlinear Optical Properties (γ) of Dendritic Molecular Aggregates: Intermolecular-Interaction and Relaxation Effects on γ

Molecular Crystals and Liquid Crystals Science and Technology Section A Molecular Crystals and Liquid Crystals ◽

10.1080/10587250108024736 ◽

2001 ◽

Vol 371 (1) ◽

pp. 261-264

Author(s):

Harunori Fujita ◽

Masayoshi Nakano ◽

Masahiro Takahata ◽

Shinji Kiribayashi ◽

Kizashi Yamaguchi

Keyword(s):

Optical Properties ◽

Intermolecular Interaction ◽

Nonlinear Optical ◽

Theoretical Study ◽

Nonlinear Optical Properties ◽

Molecular Aggregates ◽

Third Order ◽

Relaxation Effects

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Raman Intensities Induced by Electrostatic Intermolecular Interaction and Related Nonlinear Optical Properties of a Conjugated π-Electron System: A Theoretical Study

The Journal of Physical Chemistry A ◽

10.1021/jp982351u ◽

1998 ◽

Vol 102 (43) ◽

pp. 8422-8425 ◽

Author(s):

Hajime Torii ◽

Kazuhiko Furuya ◽

Mitsuo Tasumi

Keyword(s):

Optical Properties ◽

Intermolecular Interaction ◽

Nonlinear Optical ◽

Theoretical Study ◽

Electron System ◽

Nonlinear Optical Properties ◽

System A ◽

Raman Intensities

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A theoretical study of intermolecular interaction of HNO3 dimer

Journal of Molecular Structure THEOCHEM ◽

10.1016/s0166-1280(01)00632-7 ◽

2001 ◽

Vol 574 (1-3) ◽

pp. 213-220 ◽

Author(s):

Jinshan Li ◽

Feng Zhao ◽

Fuqian Jing ◽

Heming Xiao

Keyword(s):

Intermolecular Interaction ◽

Theoretical Study

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Theoretical study on intermolecular interaction of epoxyethane dimer

International Journal of Quantum Chemistry ◽

10.1002/(sici)1097-461x(2000)78:2<94::aid-qua3>3.0.co;2-c ◽

2000 ◽

Vol 78 (2) ◽

pp. 94-98 ◽

Author(s):

Jinshan Li ◽

Heming Xiao ◽

Haishan Dong

Keyword(s):

Intermolecular Interaction ◽

Theoretical Study

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The roles of heteroatoms and substituents on the molecular packing motif from herringbone to π-stacking: A theoretical study on electronic structures and intermolecular interaction of pentacene derivatives

Organic Electronics ◽

10.1016/j.orgel.2019.105606 ◽

2020 ◽

Vol 78 ◽

pp. 105606 ◽

Author(s):

Pan-Pan Lin ◽

Gui-Ya Qin ◽

Ning-Xi Zhang ◽

Jian-Xun Fan ◽

Xue-Li Hao ◽

...

Keyword(s):

Intermolecular Interaction ◽

Electronic Structures ◽

Theoretical Study ◽

Molecular Packing ◽

Π Stacking ◽

Pentacene Derivatives

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Effects of intermolecular interaction on proton tunneling: Theoretical study on two-dimensional potential energy surfaces for 9-hydroxyphenalenone-CO2/H2O complexes

The Journal of Chemical Physics ◽

10.1063/1.1592505 ◽

2003 ◽

Vol 119 (8) ◽

pp. 4159-4165 ◽

Author(s):

Hirotoshi Mori ◽

Hiroshi Sekiya ◽

Eisaku Miyoshi ◽

Koichi Mogi ◽

Yoshiko Sakai

Keyword(s):

Potential Energy ◽

Intermolecular Interaction ◽

Potential Energy Surfaces ◽

Theoretical Study ◽

Two Dimensional ◽

Proton Tunneling ◽

Energy Surfaces

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A theoretical study on the intermolecular interaction of energetic system-Nitromethane dimer

Chinese Journal of Chemistry ◽

10.1002/cjoc.20000180604 ◽

2010 ◽

Vol 18 (6) ◽

pp. 815-819 ◽

Author(s):

Jin-Shan Li ◽

He-Ming Xiao ◽

Hai-Shan Dong

Keyword(s):

Intermolecular Interaction ◽

Theoretical Study

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Theoretical Study of Intermolecular Interaction at the Lipid−Water Interface. 1. Quantum Chemical Analysis Using a Reaction Field Theory

The Journal of Physical Chemistry B ◽

10.1021/jp9700591 ◽

1997 ◽

Vol 101 (24) ◽

pp. 4810-4816 ◽

Author(s):

Minoru Sakurai ◽

Hirohisa Tamagawa ◽

Yoshio Inoue ◽

Katsuhiko Ariga ◽

Toyoki Kunitake

Keyword(s):

Field Theory ◽

Chemical Analysis ◽

Intermolecular Interaction ◽

Quantum Chemical ◽

Theoretical Study ◽

Water Interface ◽

Quantum Chemical Analysis ◽

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Theoretical study of molecular ordering in liquid crystals with the help of intermolecular interaction energy calculations

Phase Transitions ◽

10.1080/01411590008228990 ◽

2000 ◽

Vol 72 (3) ◽

pp. 211-221 ◽

Author(s):

Durga Prasad Ojha

Keyword(s):

Liquid Crystals ◽

Interaction Energy ◽

Intermolecular Interaction ◽

Theoretical Study ◽

Intermolecular Interaction Energy ◽

Energy Calculations ◽

Molecular Ordering

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Theoretical Study of Ordering in Liquid Crystals with the Help of Intermolecular Interaction Energy Calculations Part l-Anisaldehyde Azine

Molecular Crystals and Liquid Crystals ◽

10.1080/00268948408071834 ◽

1984 ◽

Vol 112 (3-4) ◽

pp. 189-196 ◽

Author(s):

Nitish K. Sanyal ◽

Mihir Roychoudhury ◽

Rajendra P. Ojha ◽

Shri Ram Shukla ◽

(Km) Kavita R. Ruhela

Keyword(s):

Liquid Crystals ◽

Interaction Energy ◽

Intermolecular Interaction ◽

Theoretical Study ◽

Intermolecular Interaction Energy ◽

Energy Calculations

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