Articles with "energetics infrared" as a keyword



Structures, energetics, and infrared spectra of the cationic monomethylamine clusters

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Published in 2019 at "Chemical Physics"

DOI: 10.1016/j.chemphys.2019.04.002

Abstract: Abstract The structures, energetics, and infrared spectra of the cationic monomethylamine clusters (MMA)n+ were studied using quantum chemical calculations. The results reveal the preference of the formation of proton-transferred CH3NH3+-NH2CH2 ion-radical contact pair structure via… read more here.

Keywords: monomethylamine clusters; energetics infrared; cationic monomethylamine; infrared spectra ... See more keywords