Molecular dynamics study of proton binding to silica surfaces

Journal of Colloid and Interface Science

Volumn 198, Issue 1, 1998, Pages 119-129

  Rustad, James R ^a   Wasserman, Evgeny ^a   Felmy, Andrew R ^a   Wilke, Chandra ^a  

^a PACIFIC NORTHWEST NATIONAL LABORATORY   (United States)

Author keywords

Interfaces; Molecular dynamics; Quartz; Solvation; Surface acidity; Surfaces

Indexed keywords

PROTON; SILICATE; SILICON DIOXIDE;

ARTICLE; CHEMICAL REACTION; HYDROGEN BOND; MOLECULAR DYNAMICS; MOLECULAR MODEL; PRIORITY JOURNAL; QUANTUM MECHANICS; SIMULATION; SOLVATION; SURFACE PROPERTY;

EID: 0032005717     PISSN: 00219797     EISSN: None     Source Type: Journal    
DOI: 10.1006/jcis.1997.5195     Document Type: Article

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