Absolute rate of thermal desorption from first-principles simulation

Journal of Physics Condensed Matter

Volumn 18, Issue 37, 2006, Pages

  Alfe D ^a   Gillan, M J ^a  

^a UNIVERSITY COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; COMPUTATION THEORY; COMPUTER SIMULATION; CONSTRAINT THEORY; MOLECULAR DYNAMICS; THERMAL EFFECTS;

ADSORBATE MOLECULES; CHEMICAL POTENTIALS; GENERALIZED GRADIENT APPROXIMATION (GGA);

DESORPTION;

EID: 33748367665     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/18/37/L02     Document Type: Article

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