Detailed balance, internal consistency, and energy conservation in fragment orbital-based surface hopping

Document type:: Zeitschriftenaufsatz
Author(s):: Carof, Antoine; Giannini, Samuele; Blumberger, Jochen
Title:: Detailed balance, internal consistency, and energy conservation in fragment orbital-based surface hopping
Journal title:: The Journal of Chemical Physics
Year:: 2017
Journal volume:: 147
Journal issue:: 21
Pages contribution:: 214113
Fulltext / DOI:: doi:10.1063/1.5003820
Publisher:: AIP Publishing
E-ISSN:: 0021-96061089-7690
Date of publication:: 07.12.2017
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