Fugacity Coefficients for Free Radicals in Dense Fluids: HO2 in Supercritical Water

AIChE Journal

Volumn 43, Issue 5, 1997, Pages 1287-1299

  Mizan, Tahmid I ^a,b   Savage, Phillip E ^a   Ziff, Robert M ^a  

^a UNIVERSITY OF MICHIGAN   (United States)

^b University of Delaware   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; COMPUTER SIMULATION; FREE ENERGY; FREE RADICAL REACTIONS; MOLECULAR DYNAMICS; PERTURBATION TECHNIQUES;

DYNAMIC COUPLING PARAMETER WINDOW MODIFICATION TECHNIQUE; FUGACITY COEFFICIENTS; HYDROPEROXY RADICAL; SUPERCRITICAL WATER;

FREE RADICALS;

EID: 0031145867     PISSN: 00011541     EISSN: None     Source Type: Journal    
DOI: 10.1002/aic.690430517     Document Type: Article

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