Localized electron wave packet description of chemical bond and excitation: Floating and breathing Gaussian with valence-bond coupling-Reference-Cited by-同舟云学术

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Localized electron wave packet description of chemical bond and excitation: Floating and breathing Gaussian with valence-bond coupling

Published:2017-09 Issue: Volume:1116 Page:159-162
ISSN:2210-271X
Container-title:Computational and Theoretical Chemistry
language:en
Short-container-title:Computational and Theoretical Chemistry

Author:

Ando Koji

Funder

KAKENHI

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry

Reference34 articles.

1. The Nature of the Chemical Bond;Pauling,1960

2. The electronic structure of the benzene molecule;Cooper;Nature,1986

3. Computer Modeling of Chemical Reactions in Enzymes and Solution;Warshel,1991

4. Valence bond theory for chemical dynamics;Truhlar;J. Comput. Chem.,2006

5. A Chemist’s Guide to Valence Bond Theory;Shaik,2008

Cited by 6 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Potential energy surfaces for electron dynamics from a model of localized Gaussian wave packets with valence-bond spin-coupling: High-harmonic generation spectra from H and He atoms;Chemical Physics;2023-06

2. Electron Dynamics in Molecular Elementary Processes and Chemical Reactions;Bulletin of the Chemical Society of Japan;2021-04-15

3. Single-electron quantum dynamics in high-harmonic generation spectrum from LiH molecule: Analysis of potential energy surfaces for electrons constructed from a model of localized Gaussian wave packets with valence-bond spin-coupling;The Journal of Chemical Physics;2020-02-28

4. Automatic spatial extension of a time-dependent wavefunction expanded in terms of Gaussians: Application to multidimensional tunneling;Chemical Physics Letters;2018-09

5. Potential energy surfaces for electron dynamics modeled by floating and breathing Gaussian wave packets with valence-bond spin-coupling: An analysis of high-harmonic generation spectrum;The Journal of Chemical Physics;2018-03-05

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