Nonadiabatic coupling terms for the GVVPT2 variant of multireference perturbation theory
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference44 articles.
1. Diabatic Potential Energy Surfaces for Charge-Transfer Processes
2. The Classical Trajectory-Surface-Hopping Approach to Charge-Transfer Processes
3. Radial couplings for charge transfer
4. First-order nonadiabatic couplings from time-dependent hybrid density functional response theory: Consistent formalism, implementation, and performance
5. Analytic evaluation of the nonadiabatic coupling vector between excited states using equation-of-motion coupled-cluster theory
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