Structure, bonding, and stability of a catalytica platinum(II) catalyst: A computational study

Organometallics

Volumn 22, Issue 10, 2003, Pages 2057-2068

  Xu, Xin ^a,c   Kua, Jeremy ^a   Periana, Roy A ^b   Goddard III, William A ^a  

^a CALIFORNIA INSTITUTE OF TECHNOLOGY   (United States)

^b UNIVERSITY OF SOUTHERN CALIFORNIA   (United States)

^c XIAMEN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; BOND STRENGTH (CHEMICAL); CATALYSIS; CATALYSTS; CHEMICAL BONDS; CHLORINE COMPOUNDS; PRECIPITATION (CHEMICAL); PROBABILITY DENSITY FUNCTION; PROTONS; QUANTUM THEORY; STRUCTURE (COMPOSITION); SULFURIC ACID;

AMMINE LIGAND; BISULFATE LIGAND; CHLORIDE LIGAND; DENSITY FUNCTIONAL THEORY; POISSON-BOLTZMANN CONTINUUM APPROXIMATION; PROTONATION;

PLATINUM COMPOUNDS;

EID: 0037481958     PISSN: 02767333     EISSN: None     Source Type: Journal    
DOI: 10.1021/om0202165     Document Type: Article

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