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Published in 2018 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.7b11002
Abstract: Computational crystal-phase prediction means have become an important tool in materials science for the acceleration of material discovery. Material phases stabilized by substantial entropic effects, however, cannot be accounted for with today’s widely used methods.…
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Keywords:
phases case;
silver iodide;
case silver;
entropically stabilized ... See more keywords