Relaxation and electronic structure of the V2O3(0001) surface: Ab initio cluster model studies

Surface Science

Volumn 525, Issue 1-3, 2003, Pages 33-45

  Czekaj, I ^a,b   Hermann, K ^b   Witko, M ^a  

^a INSTITUTE OF CATALYSIS AND SURFACE CHEMISTRY   (Poland)

^b FRITZ HABER INSTITUT DER MAX PLANCK GESELLSCHAFT   (Germany)

Author keywords

Clusters; Density functional calculations; Surface relaxation and reconstruction; Vanadium oxide

Indexed keywords

CHEMICAL BONDS; CRYSTAL STRUCTURE; ELECTRONIC STRUCTURE; PROBABILITY DENSITY FUNCTION; RELAXATION PROCESSES; STOICHIOMETRY;

IONIC CHARGING;

VANADIUM COMPOUNDS;

EID: 0037429157     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(02)02547-5     Document Type: Article

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