Binding sites for SiH2/Si(0 0 1): A combined ab initio, tight-binding, and classical investigation

Surface Science

Volumn 600, Issue 19, 2006, Pages 4445-4453

  Cereda, S ^a   Montalenti, F ^a   Cogoni, M ^a   Branduardi, D ^b   Radny, M W ^c   Smith, P V ^c   Miglio, Leo ^a  

^a UNIVERSITY OF MILANO BICOCCA   (Italy)

^b ETH ZURICH   (Switzerland)

^c UNIVERSITY OF NEWCASTLE   (Australia)

Author keywords

Atom surface interaction; Density functional theory; Empirical calculations; Molecular dynamics; Semiempirical tight binding; SiH2 binding sites; Silicon

Indexed keywords

ADSORPTION; APPROXIMATION THEORY; GRADIENT METHODS; MOLECULAR DYNAMICS; PROBABILITY DENSITY FUNCTION;

ATOM-SURFACE INTERACTION; EMPIRICAL CALCULATIONS; SEMIEMPIRICAL TIGHT-BINDING; SIH2 BINDING SITES;

SILICON COMPOUNDS;

EID: 33749059969     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2006.07.009     Document Type: Article

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