Oligomeric vanadium oxide species supported on the CeO2(111) surface: Structure and reactivity studied by density functional theory

Journal of Physical Chemistry C

Volumn 117, Issue 10, 2013, Pages 5274-5285

  Penschke, Christopher ^a   Paier, Joachim ^a   Sauer, Joachim ^a  

^a HUMBOLDT UNIVERSITY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CHAINLIKE STRUCTURE; COULOMB CORRELATIONS; HIGH REACTIVITY; PERIODIC DENSITY FUNCTIONAL THEORY; REACTIVITY DESCRIPTORS; RELAXATION EFFECT; STRETCHING MODES; VANADIA CATALYSTS;

ATOMS; DENSITY FUNCTIONAL THEORY; DIMERS; HYDROGENATION; MONOMERS; OXYGEN; VANADIUM COMPOUNDS;

SURFACE DEFECTS;

EID: 84875206468     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp400520j     Document Type: Article

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