A Numerical Model for Nonadiabatic Transitions in Molecules

In molecules, electronic state transitions can occur via quantum coupling of the states. If the coupling is due to the kinetic energy of the molecular nuclei, then electronic transitions are best represented in the adiabatic frame. If the coupling is instead facilitated through the potential energy...

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Bibliographic Details
Main Author: Agrawal, Devanshu
Format: Others
Published: Digital Commons @ East Tennessee State University 2014
Subjects:
Online Access:https://dc.etsu.edu/honors/193
https://dc.etsu.edu/cgi/viewcontent.cgi?article=1207&context=honors