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Derivative couplings and analytic gradients for diabatic states, with an implementation for Boys-localized configuration-interaction singles

โœ Scribed by Fatehi, Shervin; Alguire, Ethan; Subotnik, Joseph E.

Book ID
121238263
Publisher
American Institute of Physics
Year
2013
Tongue
English
Weight
770 KB
Volume
139
Category
Article
ISSN
0021-9606

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