Three-state conical intersection optimization methods: development and implementation at QM/MM level
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Title
Three-state conical intersection optimization methods: development and implementation at QM/MM level
Authors
Keywords
Three-state conical intersection, QM/MM method, Penalty function method, Photophysical and photochemical mechanisms
Journal
THEORETICAL CHEMISTRY ACCOUNTS
Volume 136, Issue 1, Pages -
Publisher
Springer Nature
Online
2016-12-07
DOI
10.1007/s00214-016-2029-z
References
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