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Published in 2017 at "Journal of Computational Chemistry"
DOI: 10.1002/jcc.24769
Abstract: This work provides a novel interpretation of elementary processes of photophysical relevance from the standpoint of the electron density using simple model reactions. These include excited states of H2 taken as a prototype for a…
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Keywords:
energy;
real space;
chemical bonding;
bonding excited ... See more keywords