Mechanism of H2 production by the [FeFe]H subcluster of di-iron hydrogenases: Implications for abiotic catalysts

Journal of Physical Chemistry B

Volumn 112, Issue 42, 2008, Pages 13381-13390

  Sbraccia, Carlo ^a   Zipoli, Federico ^a   Car, Roberto ^a,b   Cohen, Morrel H ^a,c   Dismukes, G Charles ^a   Selloni, Annabella ^a  

^a PRINCETON UNIVERSITY   (United States)

^b Princeton University   (United States)

^c RUTGERS UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON MONOXIDE; CATALYSIS; DENSITY FUNCTIONAL THEORY; ENERGY BARRIERS; ENZYMES; HYDROGEN; IRON COMPOUNDS; KETONES; LIGANDS; RATE CONSTANTS; REACTION KINETICS;

ACTIVE CENTERS; BIOINSPIRED CATALYSTS; CATALYTIC PROPERTIES; CATALYTIC SITES; CO LIGANDS; FIRST PRINCIPLES; GENERALIZED GRADIENT APPROXIMATION LEVELS; GEOMETRICAL ISOMERS; HYDROGENASES; IRON CENTERS; TERMINAL ISOMERS; X-RAY STRUCTURES;

ISOMERS;

HYDROGEN; HYDROGENASE; IRON HYDROGENASE; IRON SULFUR PROTEIN; ISOENZYME; PROTON;

ARTICLE; BIOCATALYSIS; CHEMICAL STRUCTURE; CHEMISTRY; ELECTRON; METABOLISM; OXIDATION REDUCTION REACTION; STEREOISOMERISM;

BIOCATALYSIS; ELECTRONS; HYDROGEN; HYDROGENASE; IRON-SULFUR PROTEINS; ISOENZYMES; MODELS, MOLECULAR; OXIDATION-REDUCTION; PROTONS; STEREOISOMERISM;

EID: 55649115332     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp803657b     Document Type: Article

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