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Published in 2017 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.7b02379
Abstract: Small-sized aluminum clusters exhibit a possible spin competition at finite temperatures. For this reason, it is difficult to perform standard electronic structure investigations to determine the properties of the ground states of such clusters. In…
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Keywords:
singlet triplet;
spin competition;
investigation spin;
competition ... See more keywords