Hydrolysis of a two-membered silica ring on the amorphous silica surface

Journal of Chemical Physics

Volumn 120, Issue 2, 2004, Pages 1044-1054

  Du, Mao Hua ^a   Kolchin, Andrew ^a   Cheng, Hai Ping ^a  

^a UNIVERSITY OF FLORIDA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AMORPHOUS MATERIALS; APPROXIMATION THEORY; ATOMS; CALCULATIONS; CHEMICAL BONDS; COMPUTER SIMULATION; ELECTRON TRANSPORT PROPERTIES; HYDROLYSIS; PROBABILITY DENSITY FUNCTION; PROTONS; QUANTUM THEORY; SURFACE CHEMISTRY;

AMORPHOUS SILICA; DENSITY FUNCTIONAL THEORY; GENERALIZED GRADIENT APPROXIMATION; WATER-SILICA INTERACTION;

SILICA;

EID: 0842333146     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1630026     Document Type: Article

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