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Journal of Catalysis

Volumn 278, Issue 2, 2011, Pages 200-207

Complex intermetallic compounds as selective hydrogenation catalysts - A case study for the (1 0 0) surface of Al13Co4

(2) Krajčí, Marian a,b Hafner, Jürgen a

a UNIVERSITY OF VIENNA (Austria)

b INSTITUTE OF PHYSICS (Slovakia)

Author keywords

Catalysis; Density functional theory; Hydrogenation; Intermetallic compounds; Selectivity; Transition state theory

Indexed keywords

AB INITIO; ACTIVE SITE; ADSORPTION GEOMETRIES; BASIC IDEA; COMPLEX INTERMETALLIC COMPOUNDS; COMPLEX TOPOLOGY; COVALENT BONDING; DENSITY FUNCTIONALS; DESORPTION ENERGY; HIGH ACTIVITY; HYDROGENATION PROCESS; INTERMETALLIC COMPOUNDS; LOW COORDINATION; MULTI-STEP; NOVEL CONCEPT; PD-AG CATALYSTS; RATE-CONTROLLING; SELECTIVE CATALYSTS; SELECTIVE HYDROGENATION; SELECTIVITY; STABLE CATALYSTS; SURFACE ATOMS; TRANSITION STATE THEORY; ZIG-ZAG;

ACETYLENE; ACTIVATION ENERGY; ADSORPTION; ALUMINUM; ATOMS; CATALYSIS; CATALYSTS; COBALT; COORDINATION REACTIONS; DENSITY FUNCTIONAL THEORY; DESORPTION; ETHYLENE; HYDROGENATION; INTERMETALLICS; SOLDERING ALLOYS; SURFACE STRUCTURE; TIME VARYING SYSTEMS; WAVE FUNCTIONS;

COBALT COMPOUNDS;

EID: 79951676811 PISSN: 00219517 EISSN: 10902694 Source Type: Journal
DOI: 10.1016/j.jcat.2010.12.004 Document Type: Article

Times cited : (57)

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