Articles with "anharmonicity vibrational" as a keyword



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Anharmonicity of Vibrational Modes in Hydrogen Chloride-Water Mixtures.

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Published in 2019 at "Journal of chemical theory and computation"

DOI: 10.1021/acs.jctc.8b01070

Abstract: A thorough analysis of molecular vibrations in the binary system hydrogen chloride/water is presented considering a set of small mixed and pure clusters. In addition to the conventional normal-mode analysis based on the diagonalization of… read more here.

Keywords: hydrogen chloride; anharmonicity constants; anharmonicity vibrational; anharmonicity ... See more keywords