Reversible catalytic reactions and the stability of Ti surface defects in NaAIH 4

Chemistry of Materials

Volumn 20, Issue 24, 2008, Pages 7539-7544

  Bai, Kewu ^a   Yeo, Pei Shan Emmeline ^a   Wu, Ping ^a  

^a INSTITUTE OF HIGH PERFORMANCE COMPUTING   (Singapore)

Author keywords

[No Author keywords available]

Indexed keywords

CATALYTIC BEHAVIORS; CATALYTIC REACTIONS; CATALYTIC ROLES; CONCENTRATION OF; CONTROVERSIAL TOPICS; DEFECT STABILITIES; DENSITY FUNCTIONAL; FORMATION ENTHALPIES; H-BONDS; PHASE EQUILIBRIUM CALCULATIONS; REHYDROGENATION; REVERSIBLE DEHYDROGENATIONS; RICH CONDITIONS; STABLE SURFACES; SUB-SURFACE LAYERS; THEORETICAL STUDIES;

ALUMINUM; CATALYSIS; CATALYSTS; DEFECT DENSITY; DEHYDROGENATION; DENSITY FUNCTIONAL THEORY; HYDROGEN; PHASE EQUILIBRIA;

SURFACE DEFECTS;

EID: 61849112667     PISSN: 08974756     EISSN: None     Source Type: Journal    
DOI: 10.1021/cm8016038     Document Type: Article

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