Adsorption of functionalized benzoic acids on MgSO4· H2O (100)

ChemPhysChem

Volumn 7, Issue 5, 2006, Pages 1055-1061

  Maslyuk, Volodymyr ^a   Tegenkamp, Christoph ^a   Pfnür, Herbert ^a   Bredow, Thomas ^a  

^a LEIBNIZ UNIVERSITY HANNOVER   (Germany)

Author keywords

ab initio calculations; Adsorption; Chemisorption; Insulating surfaces; Single molecule studies

Indexed keywords

ADSORPTION; BENZOIC ACID; BINDING ENERGY; CALCULATIONS; CHARGE TRANSFER; CHEMICAL BONDS; CHEMISORPTION; DENSITY FUNCTIONAL THEORY; ELECTRONIC PROPERTIES; ENERGY GAP; GEOMETRY; MAGNESIUM COMPOUNDS; MOLECULAR ORBITALS; MOLECULES;

AB INITIO CALCULATIONS; ADSORPTION GEOMETRIES; ELECTROSTATIC SEPARATION; INSULATING SURFACES; NONPLANAR GEOMETRY; SEMI-EMPIRICAL METHODS; SINGLE-MOLECULE STUDIES; WIDE BAND GAP INSULATOR;

SALICYLIC ACID;

EID: 33646754902     PISSN: 14394235     EISSN: 14397641     Source Type: Journal    
DOI: 10.1002/cphc.200500486     Document Type: Article

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