Strongly localized molecular orbitals for α-quartz

Journal of Physics Condensed Matter

Volumn 16, Issue 41, 2004, Pages 7233-7246

  Danyliv, Oleh ^a,b   Kantorovich, Lev ^a  

^a KING'S COLLEGE LONDON   (United Kingdom)

^b INSTITUTE FOR CONDENSED MATTER PHYSICS   (Ukraine)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; APPROXIMATION THEORY; BOUNDARY CONDITIONS; CHEMICAL BONDS; CRYSTALLINE MATERIALS; EIGENVALUES AND EIGENFUNCTIONS; ELECTRONIC STRUCTURE; MATHEMATICAL MODELS; MOLECULAR DYNAMICS; PERTURBATION TECHNIQUES; POINT DEFECTS;

COVALENT BONDING; HARTREE-FOCK APPROXIMATION; LOCALIZED MOLECULAR ORBITALS (LMO);

QUARTZ;

EID: 7044220554     PISSN: 09538984     EISSN: None     Source Type: Journal    
DOI: 10.1088/0953-8984/16/41/006     Document Type: Review

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