A theoretical study of the stability and electronic structure of the polar {111} face of mgo

Surface Science

Volumn 387, Issue 1-3, 1997, Pages 354-370

  Pojani, A ^a   Finocchi, F ^a   Goniakowski, J ^b   Noguera, C ^a  

^a UNIVERSITÉ PARIS SUD   (France)

^b CAMPUS DE LUMINY   (France)

Author keywords

Faceting; Magnesium oxides; Semi empirical models and model calculations; Surface energy; Surface relaxation and reconstruction

Indexed keywords

COMPUTATIONAL METHODS; CRYSTAL ORIENTATION; ELECTRONIC STRUCTURE; ENERGY GAP; FERMI LEVEL; INTERFACIAL ENERGY; MATHEMATICAL MODELS; METALLIZING; PERTURBATION TECHNIQUES; RELAXATION PROCESSES; STOICHIOMETRY; SURFACE STRUCTURE;

HARTREE FOCK METHOD; SEMI EMPIRICAL MODELS; SURFACE RECONSTRUCTION; SURFACE RELAXATION;

MAGNESIA;

EID: 0031560001     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(97)00373-7     Document Type: Article

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