Exploring rapid nuclear motion in molecular dyads
have found that while simple consideration of the equilibrium geometries is unable to reproduce the experimental results, we have been able to use molecular dynamics and vibrational coordinate analysis to rationalize the rapid electron transfer. Specifically, certain vibrations of MesAcr promote the...
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University of Newcastle Upon Tyne
2008
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| Online Access: | http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.556133 |