An improved cluster pair correlation method for obtaining the absolute proton hydration energy and enthalpy evaluated with an expanded data set

Journal of Physical Chemistry B

Volumn 114, Issue 41, 2010, Pages 13189-13200

  Donald, William A ^a   Williams, Evan R ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CLUSTER ANALYSIS; CORRELATION METHODS; ENTHALPY; FREE ENERGY; HYDRATION; MOLECULES;

CLUSTER SIZES; DATA SET SIZE; DATA SETS; HYDRATION ENERGIES; HYDRATION ENTHALPY; HYDRATION ENTROPY; HYDRATION FREE ENERGIES; IMPROVED METHODS; PAIR-CORRELATION METHOD; SIX WATER MOLECULES; SMALL CLUSTERS; WATER MOLECULE;

PROTONS;

EID: 77958055064     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp1068945     Document Type: Article

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