Change in Energy of Intermolecular Hydrogen Bonds Upon Excitation of Coumarin 120 in Water: A Combined Time-dependent Density Functional Theory/Effective Fragment Potential Study
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Journal Article Details
Publisher Name: Global Science Press
Language: English
DOI: https://doi.org/10.4208/cicc.2015.v3.n1.3
Communications in Computational Chemistry, Vol. 3 (2015), Iss. 1 : pp. 18–33
Published online: 2015-01
AMS Subject Headings: Global Science Press
Copyright: COPYRIGHT: © Global Science Press
Pages: 16
Keywords: TDDFT EFP B3LYP HB C120-(H$_2$O)$_7$ complex.