Are the intramolecular O-H...F and O-H...Cl hydrogen bonds maintained in solution? A theoretical study

Journal of Physical Chemistry A

Volumn 117, Issue 13, 2013, Pages 2812-2826

  Nagy, Peter I ^a  

^a UNIVERSITY OF TOLEDO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; CARBON TETRACHLORIDE; DESIGN FOR TESTABILITY; ELECTRIC CIRCUIT BREAKERS; ETHANOL; FREE ENERGY; MONTE CARLO METHODS; ORGANIC SOLVENTS; PERTURBATION TECHNIQUES; PHENOLS; SOLUTIONS;

AQUEOUS SOLUTION COMPOSITION; COMPLETE BASIS SETS; CONTINUUM SOLVENTS; FREE-ENERGY PERTURBATION METHODS; INTRA-MOLECULAR HYDROGEN BONDS; SOLUTION STRUCTURES; SOLVATION FREE ENERGIES; THEORETICAL METHODS;

HYDROGEN BONDS;

EID: 84962385202     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp310596c     Document Type: Article

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