Comparative dynamical study of the HD and H2 isotopomers interacting with Pd(1 1 1) and Cu(1 1 0) surfaces

Surface Science

Volumn 603, Issue 21, 2009, Pages 3171-3178

  Ramirez C A ^a   Busnengo, H F ^a  

^a INSTITUTO DE FÍSICA ROSARIO   (Argentina)

Author keywords

Adsorption; Molecular dynamics; Rotational excitation

Indexed keywords

ADSORPTION PROBABILITIES; CLASSICAL TRAJECTORIES; CU(1 0 0); CU(1 1 0); DENSITY FUNCTIONAL THEORY CALCULATIONS; DISSOCIATIVE ADSORPTION; EXPERIMENTAL VALUES; IMPACT ENERGY; ISOTOPIC EFFECTS; ISOTOPOMERS; MASS DISTRIBUTION; PD(1 1 1); ROTATIONAL ENERGY DISTRIBUTION; ROTATIONAL EXCITATION; ROTATIONAL TEMPERATURE; SCATTERING PROCESS; TRANSLATIONAL ENERGY; ZERO-POINT ENERGIES;

ADSORPTION; DENSITY FUNCTIONAL THEORY; ISOTOPES; MOLECULAR DYNAMICS; MOLECULES; PALLADIUM; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY;

PROBABILITY;

EID: 70349994356     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2009.07.017     Document Type: Article

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