Generalization of the local diabatization approach for propagating electronic degrees of freedom in nonadiabatic dynamics.
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| Title: | Generalization of the local diabatization approach for propagating electronic degrees of freedom in nonadiabatic dynamics. |
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| Authors: | Shakiba, Mohammad1 (AUTHOR), Akimov, Alexey V.1 (AUTHOR) alexeyak@buffalo.edu |
| Source: | Theoretical Chemistry Accounts: Theory, Computation, & Modeling. Aug2023, Vol. 142 Issue 8, p1-17. 17p. |
| Database: | Academic Search Ultimate |
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| ISSN: | 1432881X |
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| DOI: | 10.1007/s00214-023-03007-7 |
