Electronic couplings for molecular charge transfer: benchmarking CDFT, FODFT, and FODFTB against high-level ab initio calculations

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Bibliographic Details
Other Authors: Kubas, Adam (Other) , Elstner, Marcus (Other)
Format: Article (Journal)
Language:English
Published: 2014
In: The journal of chemical physics
Year: 2014, Volume: 140, Issue: 10
ISSN:1089-7690
DOI:10.1063/1.4867077
Online Access:Verlag, Volltext: http://dx.doi.org/10.1063/1.4867077
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Author Notes:Adam Kubas, Felix Hoffmann, Alexander Heck, Harald Oberhofer, Marcus Elstner and Jochen Blumberger
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Item Description:Gesehen am 16.05.2015
Physical Description:Online Resource
ISSN:1089-7690
DOI:10.1063/1.4867077