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Published in 2021 at "Molecular Physics"
DOI: 10.1080/00268976.2021.1979263
Abstract: Methylketene (CH3CHCO) and acrolein (CH2CHCHO) have received considerable attention from both theoreticians and experimentalists. In a number of computational studies, it has been identified that b...
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Keywords:
minimum c3h4o;
global minimum;
c3h4o surface;
conjugation trumps ... See more keywords