Condensed phase electron transfer beyond the Condon approximation
Condensed phase electron transfer problems are often simplified by making the Condon approximation: the approximation that the coupling connecting two charge-transfer diabatic states is a constant. Unfortunately, the Condon approximation does not predict the existence of conical intersections, which...
Main Authors: | Mavros, Michael G. (Author), Hait, Diptarka (Contributor), Van Voorhis, Troy (Contributor), Mavros, Michael George (Contributor) |
---|---|
Format: | Article |
Language: | English |
Published: |
American Chemical Society (ACS),
2018-04-30T18:09:08Z.
|
Subjects: | |
Online Access: | Get fulltext |
Similar Items
-
A hybrid memory kernel approach for condensed phase non-adiabatic dynamics
by: Hait, Diptarka, et al.
Published: (2018) -
Resummed memory kernels in generalized system-bath master equations
by: Van Voorhis, Troy, et al.
Published: (2015) -
Electron transfer in solution : nonadiabatic dynamics and applications to catalysis
by: Mavros, Michael G. (Michael George)
Published: (2016) -
Theoretical studies on the properties and dynamics of electronic excited states
by: Hait, Diptarka
Published: (2016) -
Prediction of Excited-State Energies and Singlet-Triplet Gaps of Charge-Transfer States Using a Restricted Open-Shell Kohn-Sham Approach
by: Hait, Diptarka, et al.
Published: (2018)