A second generation multistate empirical valence bond model for proton transport in aqueous systems

Journal of Chemical Physics

Volumn 117, Issue 12, 2002, Pages 5839-5849

  Day, Tyler J F ^a   Soudackov, Alexander V ^a   Čuma, Martin ^a   Schmitt, Udo W ^a   Voth, Gregory A ^a  

^a UNIVERSITY OF UTAH   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; COMPUTER SIMULATION; DIFFUSION; MATHEMATICAL MODELS; PROTONS;

PROTON TRANSPORT; VALENCE BOND MODEL;

MOLECULAR DYNAMICS;

EID: 0037159065     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1497157     Document Type: Article

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