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Rovibrational states, electron nuclear dynamics analysis

Rovibrational states, electron nuclear dynamics (END), molecular systems, final-state analysis, 344-349... [Pg.96]

In Chapter VI, Ohm and Deumens present their electron nuclear dynamics (END) time-dependent, nonadiabatic, theoretical, and computational approach to the study of molecular processes. This approach stresses the analysis of such processes in terms of dynamical, time-evolving states rather than stationary molecular states. Thus, rovibrational and scattering states are reduced to less prominent roles as is the case in most modem wavepacket treatments of molecular reaction dynamics. Unlike most theoretical methods, END also relegates electronic stationary states, potential energy surfaces, adiabatic and diabatic descriptions, and nonadiabatic coupling terms to the background in favor of a dynamic, time-evolving description of all electrons. [Pg.770]


See other pages where Rovibrational states, electron nuclear dynamics analysis is mentioned: [Pg.645]   
See also in sourсe #XX -- [ Pg.344 , Pg.345 , Pg.346 , Pg.347 , Pg.348 ]

See also in sourсe #XX -- [ Pg.344 , Pg.345 , Pg.346 , Pg.347 , Pg.348 ]




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Dynamic analysis

Electron analysis

Electron dynamics

Electron nuclear dynamics

Electronic states analysis

Electronic states nuclear dynamics

Nuclear analysis

Nuclear dynamics

Rovibrational

Rovibrational states, electron nuclear dynamics

Rovibrator

State dynamical

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