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
Commun. Comput. Chem., 3 (2015), pp. 18-33.
Published online: 2015-03
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@Article{CiCC-3-18,
author = {},
title = {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},
journal = {Communications in Computational Chemistry},
year = {2015},
volume = {3},
number = {1},
pages = {18--33},
abstract = {},
issn = {2617-8575},
doi = {https://doi.org/10.4208/cicc.2015.v3.n1.3},
url = {http://global-sci.org/intro/article_detail/cicc/351.html}
}
TY - JOUR
T1 - 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
JO - Communications in Computational Chemistry
VL - 1
SP - 18
EP - 33
PY - 2015
DA - 2015/03
SN - 3
DO - http://doi.org/10.4208/cicc.2015.v3.n1.3
UR - https://global-sci.org/intro/article_detail/cicc/351.html
KW - TDDFT, EFP, B3LYP, HB, C120-(H$_2$O)$_7$ complex.
AB -
Mariyappa Ramegowda. (1970). 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.
Communications in Computational Chemistry. 3 (1).
18-33.
doi:10.4208/cicc.2015.v3.n1.3
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