Examination of some new configurations of methanol-water hetero dimer system by molecular orbital and density functional calculations
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference29 articles.
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1. Red-shifted and improper blue-shifted hydrogen bonds in dimethyl ether (DME)n (n=1–4) and hydrated (DME)n (n=1–4) clusters. A theoretical study;Journal of Molecular Structure;2005-01
2. Ab initio studies of methanol, methanethiol and methylamine dimer;Journal of Molecular Structure: THEOCHEM;2002-10
3. Hydrogen bonding and cooperative effects in mixed dimers and trimers of methanol and trifluoromethanol: An ab initio study;The Journal of Chemical Physics;1999-04
4. Diffusion Monte Carlo simulations of methanol–water clusters;Chemical Physics Letters;1999-02
5. Hardness profile of interaction of H–F with He, Ne and Ar: a density functional and MP2 calculation;Chemical Physics Letters;1998-09
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