Ab Initio Multiple Spawning Dynamics Using Multi-State Second-Order Perturbation Theory-Reference-Cited by-同舟云学术

Ab Initio Multiple Spawning Dynamics Using Multi-State Second-Order Perturbation Theory

Published:2009-11-04 Issue:49 Volume:113 Page:13656-13662
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Tao Hongli¹,Levine Benjamin G.¹,Martínez Todd J.¹

Affiliation:

1. Department of Chemistry, Stanford University, Stanford, California, 94305, and Department of Chemistry, University of Pennsylvania, Philadelphia, Pennsylvania 19104

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp9063565

Reference56 articles.

1. Ab initio molecular dynamics study of cis–trans photoisomerization in ethylene

2. Ab Initio Multiple Spawning: Photochemistry from First Principles Quantum Molecular Dynamics

3. Ab initio molecular dynamics with equation-of-motion coupled-cluster theory: electronic absorption spectrum of ethylene

4. Ab initio equation-of-motion coupled-cluster molecular dynamics with ‘on-the-fly’ diabatization: the doublet-like feature in the photoabsorption spectrum of ethylene

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