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Published in 2024 at "Chemical Science"
DOI: 10.1039/d4sc06383j
Abstract: In this perspective we deal with the challenge of investigating nuclear quantum effects in solvated and condensed phase molecular systems in a computationally affordable way. To this end, semiclassical methods are promising theoretical approaches, as…
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Keywords:
solvated condensed;
phase molecular;
condensed phase;
effects solvated ... See more keywords