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Volumn 17, Issue 26, 2001, Pages 8434-8443

Combining molecular dynamics simulations and transition state theory to evaluate the sorption rate constants for decanol at the surface of water

(2) Shin, Jason Y a Abbott, Nicholas L a

a University of Wisconsin Madison (United States)

Author keywords

[No Author keywords available]

Indexed keywords

TRANSITION STATE THEORY;

ADSORPTION; COMPUTER SIMULATION; DESORPTION; FREE ENERGY; MOLECULAR DYNAMICS; MOLECULES; RATE CONSTANTS; SORPTION; WATER;

SURFACE CHEMISTRY;

EID: 0035951251 PISSN: 07437463 EISSN: None Source Type: Journal
DOI: 10.1021/la0106891 Document Type: Article

Times cited : (24)

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