A density functional theory evaluation of hydrophobic solvation: Ne, Ar and Kr in a 50-water cluster - Implications for the hydrophobic effect

Computational and Theoretical Chemistry

Volumn 990, Issue , 2012, Pages 214-221

  Kobko, Nadya ^a   Marianski, Mateusz ^a   Asensio, Amparo ^b   Wieczorek, Robert ^c   Dannenberg, J J ^a  

^a CITY UNIVERSITY OF NEW YORK   (United States)

^b UNIVERSITY OF VALENCIA   (Spain)

^c UNIVERSITY OF WROC AW   (Poland)

Author keywords

DFT; Hydrophobic; Solvation; Water

Indexed keywords

EID: 84862094712     PISSN: 2210271X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.comptc.2011.11.022     Document Type: Article

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