Article ID Journal Published Year Pages File Type
5375111 Chemical Physics 2010 9 Pages PDF
Abstract
The spin-orbit coupling as a function of nuclear geometry for benzene and cyclobutadiene is investigated, which may play a role in the ultrafast dynamics of these molecules. Distortions along C-H bends are particularly important.
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Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
The effect of molecular distortions on spin-orbit coupling in simple hydrocarbons
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