Direct methods for non-adiabatic dynamics: connecting the single-set variational multi-configuration Gaussian (vMCG) and Ehrenfest perspectives
Author:
Funder
Engineering and Physical Sciences Research Council (GB)UK
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry
Link
http://link.springer.com/content/pdf/10.1007/s00214-016-1937-2.pdf
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3. Vibók Á, Csehi A, Gindensperger E, Köppel H, Halász GJ (2012) J Phys Chem A 116(11):2629. doi: 10.1021/jp2068528
4. Worth GA, Meyer HD, Köppel H, Cederbaum LS, Burghardt I (2008) Int Rev Phys Chem 27(3):569. doi: 10.1080/01442350802137656
5. Burghardt I, Meyer HD, Cederbaum LS (1999) J Chem Phys 111(7):2927. doi: 10.1063/1.479574
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