Six-dimensional quasiclassical and quantum dynamics of H2 dissociation on the c(2 2)-Ti/Al(100) surface

Journal of Chemical Physics

Volumn 134, Issue 11, 2011, Pages

  Chen, Jian Cheng ^a   Juanes Marcos, Juan Carlos ^a,b   Woittequand, Sylvain ^a   Somers, Mark F ^a   Daz, Cristina ^a,c   Olsen, Roar A ^a,d   Kroes, Geert Jan ^a  

^a LEIDEN UNIVERSITY   (Netherlands)

^b UNIVERSITY OF NEVADA   (United States)

^c UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^d OSLO METROPOLITAN UNIVERSITY   (Norway)

Author keywords

[No Author keywords available]

Indexed keywords

CLASSICAL TRAJECTORIES; DISSOCIATION PROBABILITY; ENERGY RANGES; INCIDENT ENERGY; INITIAL CONDITIONS; MOLECULAR ADSORPTION; QUANTUM DYNAMICS; QUASICLASSICAL TRAJECTORIES; REACTION PROBABILITY; SLAB MODEL; TI ATOMS; TIME-DEPENDENT WAVES; VIBRATIONAL EXCITATION;

ADSORPTION; PROBABILITY; QUANTUM CHEMISTRY; QUANTUM THEORY; REACTION RATES; TRAJECTORIES;

DISSOCIATION;

EID: 79953222952     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3567397     Document Type: Article

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