Solvation dynamics of benzonitrile excited state in polar solvents:  A time-dependent reference interaction site model self-consistent  field approach

Tateki Ishida; Fumio Hirata; Shigeki Kato

doi:10.1063/1.479083

Solvation dynamics of benzonitrile excited state in polar solvents: A time-dependent reference interaction site model self-consistent field approach

The Journal of Chemical Physics ◽

10.1063/1.479083 ◽

1999 ◽

Vol 110 (23) ◽

pp. 11423-11432 ◽

Cited By ~ 22

Author(s):

Tateki Ishida ◽

Fumio Hirata ◽

Shigeki Kato

Keyword(s):

Excited State ◽

Time Dependent ◽

Solvation Dynamics ◽

Polar Solvents ◽

Interaction Site ◽

Field Approach ◽

Site Model ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Solvent electronic polarization effect on the electronic transitions in solution: Charge polarizable reference interaction site model self-consistent field approach

The Journal of Chemical Physics ◽

10.1063/1.479329 ◽

1999 ◽

Vol 111 (2) ◽

pp. 481-491 ◽

Cited By ~ 10

Author(s):

Kazunari Naka ◽

Akihiro Morita ◽

Shigeki Kato

Keyword(s):

Polarization Effect ◽

Electronic Transitions ◽

Electronic Polarization ◽

Interaction Site ◽

Field Approach ◽

Site Model ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Reference Interaction Site

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Time-dependent density functional theory (TD-DFT) coupled with reference interaction site model self-consistent field explicitly including spatial electron density distribution (RISM-SCF-SEDD)

The Journal of Chemical Physics ◽

10.1063/1.4962062 ◽

2016 ◽

Vol 145 (9) ◽

pp. 094101 ◽

Cited By ~ 10

Author(s):

D. Yokogawa

Keyword(s):

Electron Density Distribution ◽

Density Functional ◽

Time Dependent ◽

Functional Theory ◽

Interaction Site ◽

Site Model ◽

Consistent Field ◽

Td Dft ◽

Self Consistent ◽

Self Consistent Field

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Excited-state free energy surfaces in solution: Time-dependent density functional theory/reference interaction site model self-consistent field method

The Journal of Chemical Physics ◽

10.1063/1.4811201 ◽

2013 ◽

Vol 138 (24) ◽

pp. 244101 ◽

Cited By ~ 8

Author(s):

Noriyuki Minezawa

Keyword(s):

Density Functional ◽

Field Method ◽

Time Dependent ◽

Functional Theory ◽

Interaction Site ◽

Site Model ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Energy Surfaces

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Theoretical Study on Electronic and Spin Structures of [Fe2S2]2+,+Cluster: Reference Interaction Site Model Self-Consistent Field (RISM-SCF) and Multireference Second-Order Møller−Plesset Perturbation Theory (MRMP) Approach

The Journal of Physical Chemistry A ◽

10.1021/jp0581429 ◽

2005 ◽

Vol 109 (43) ◽

pp. 9867-9874 ◽

Cited By ~ 11

Author(s):

Masahiro Higashi ◽

Shigeki Kato

Keyword(s):

Perturbation Theory ◽

Theoretical Study ◽

Spin Structures ◽

Interaction Site ◽

Site Model ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Moller Plesset ◽

Plesset Perturbation Theory

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Linear response approximation to reference interaction site model self-consistent field explicitly including spatial electron density distribution. Free energy

The Journal of Chemical Physics ◽

10.1063/1.4802001 ◽

2013 ◽

Vol 138 (16) ◽

pp. 164109 ◽

Cited By ~ 4

Author(s):

D. Yokogawa

Keyword(s):

Free Energy ◽

Density Distribution ◽

Electron Density ◽

Linear Response ◽

Electron Density Distribution ◽

Interaction Site ◽

Site Model ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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On the validity of the time-dependent self-consistent-field. approach: application to the vibrational predissociation of Cl2–Ne

Chemical Physics Letters ◽

10.1016/s0009-2614(98)00502-8 ◽

1998 ◽

Vol 290 (1-3) ◽

pp. 155-163 ◽

Cited By ~ 4

Author(s):

A Garcı́a-Vela

Keyword(s):

Time Dependent ◽

Vibrational Predissociation ◽

Field Approach ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Three-Dimensional Reference Interaction Site Model Self-Consistent Field Study on the Coordination Structure and Excitation Spectra of Cu(II)–Water Complexes in Aqueous Solution

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.9b01364 ◽

2019 ◽

Vol 123 (15) ◽

pp. 3344-3354 ◽

Cited By ~ 1

Author(s):

Chen Yang ◽

Yoshihiro Watanabe ◽

Norio Yoshida ◽

Haruyuki Nakano

Keyword(s):

Aqueous Solution ◽

Field Study ◽

Three Dimensional ◽

Coordination Structure ◽

Excitation Spectra ◽

Interaction Site ◽

Site Model ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Quantum-Classical Mixed Mode Analysis of Nonlinearly Coupled Oscillators: A Time-Dependent Self-Consistent-Field Approach

Berichte der Bunsengesellschaft für physikalische Chemie ◽

10.1002/bbpc.19920960207 ◽

1992 ◽

Vol 96 (2) ◽

pp. 142-146 ◽

Cited By ~ 7

Author(s):

E. Yurtsever ◽

J. Brickmann

Keyword(s):

Coupled Oscillators ◽

Mixed Mode ◽

Time Dependent ◽

Mode Analysis ◽

Field Approach ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Analytical energy gradient for reference interaction site model self-consistent field explicitly including spatial electron density distribution

The Journal of Chemical Physics ◽

10.1063/1.3265856 ◽

2009 ◽

Vol 131 (21) ◽

pp. 214504 ◽

Cited By ~ 27

Author(s):

Daisuke Yokogawa ◽

Hirofumi Sato ◽

Shigeyoshi Sakaki

Keyword(s):

Density Distribution ◽

Electron Density ◽

Electron Density Distribution ◽

Interaction Site ◽

Site Model ◽

Consistent Field ◽

Energy Gradient ◽

Self Consistent ◽

Self Consistent Field ◽

Reference Interaction Site

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Time-dependent self-consistent field approach to infrared laser multiphoton excitation

Chemical Physics Letters ◽

10.1016/0009-2614(87)80146-x ◽

1987 ◽

Vol 139 (1) ◽

pp. 35-40 ◽

Cited By ~ 1

Author(s):

Jeff Needels ◽

Shih-I Chu

Keyword(s):

Infrared Laser ◽

Time Dependent ◽

Multiphoton Excitation ◽

Field Approach ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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