The journal of physical chemistry. A
Pushing the Boundaries of Spectroscopic Accuracy: from Small Sheet to Large Bowl Models of Graphene.
Luigi Crisci, Federico Lazzari, Vincenzo Barone
Published: 202510.1021/acs.jpca.5c06530
Abstract
Polycyclic aromatic hydrocarbons (PAHs) play a pivotal role in combustion chemistry, astrochemistry, and materials science, while also serving as molecular prototypes of graphene. Rotational spectroscopy offers unparalleled structural accuracy but re…
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