Simulation of electrocatalytic hydrogen production by a bioinspired catalyst anchored to a pyrite electrode

Journal of the American Chemical Society

Volumn 132, Issue 25, 2010, Pages 8593-8601

  Zipoli, Federico ^a   Car, Roberto ^a,b   Cohen, Morrel H ^a,c   Selloni, Annabella ^a  

^a PRINCETON UNIVERSITY   (United States)

^b Princeton Institute for the Science and Technology of Materials Princeton University ^*  (United States)

^c State University of New Jersey   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CATALYSTS; GAS PRODUCERS; PHOTOCATALYSIS; SULFUR;

ACIDIFIED WATERS; ACTIVE SITE; BIOINSPIRED CATALYSTS; ELECTROCATALYTIC; FIRST-PRINCIPLES; FUNCTIONALIZED; HYDROGENASES; THEORETICAL STUDY;

HYDROGEN PRODUCTION;

ENZYME; FERROUS SULFIDE; HYDROGEN; PYRITE; HYDROGENASE; IRON; IRON HYDROGENASE; IRON SULFUR PROTEIN; PROTON; SULFIDE; WATER;

ARTICLE; CATALYST; CHEMICAL STRUCTURE; ELECTRODE; PHOTOCATALYSIS; PROTON TRANSPORT; STOICHIOMETRY; BIOMIMETICS; CATALYSIS; CHEMISTRY; ELECTROCHEMISTRY; ENZYME ACTIVE SITE; METABOLISM; MOLECULAR DYNAMICS; OXIDATION REDUCTION REACTION; SURFACE PROPERTY;

BIOMIMETICS; CATALYSIS; CATALYTIC DOMAIN; ELECTROCHEMISTRY; ELECTRODES; HYDROGEN; HYDROGENASE; IRON; IRON-SULFUR PROTEINS; MOLECULAR DYNAMICS SIMULATION; OXIDATION-REDUCTION; PROTONS; SULFIDES; SURFACE PROPERTIES; WATER;

EID: 77953877857     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja910694p     Document Type: Article

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