TITLE

Nonadiabatic simulation of valence electrons in solids under sustained shockwaves

AUTHOR(S)
Mathieu, D.; Martin, P.; Simonetti, P.
PUB. DATE
April 2000
SOURCE
AIP Conference Proceedings;2000, Vol. 505 Issue 1, p409
SOURCE TYPE
Academic Journal
DOC. TYPE
Article
ABSTRACT
A computational approach to nonadiabatic interband transitions in solids is o?utlined, with applications to energetic materials or semiconductors in view. The description of transition rates in terms of the time-dependent electronic wavefunction is discussed and numerical results obtained for 1D clusters are presented. It is pointed out that the main limitations of the present model are due to the lack of a proper account of environmental effects.
ACCESSION #
5985500

 

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