Bulk and (100) surface d → d excitation energies in NiO from first-principles Hartree-Fock calculations

Surface Science

Volumn 457, Issue 1, 2000, Pages

  MacKrodt, W C ^a   Noguera, Claudine ^b  

^a UNIVERSITY OF ST ANDREWS   (United Kingdom)

^b UNIVERSITÉ PARIS SUD   (France)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION SPECTROSCOPY; CALCULATIONS; CARRIER CONCENTRATION; ELECTRON ENERGY LEVELS; ELECTRON ENERGY LOSS SPECTROSCOPY; ELECTRONIC STRUCTURE; QUANTUM THEORY; SINGLE CRYSTALS; SURFACE STRUCTURE;

EXCITATION ENERGY; HARTREE-FOCK CALCULATION; NICKEL OXIDE; QUANTUM CHEMISTRY;

NICKEL COMPOUNDS;

EID: 0033701136     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(00)00405-2     Document Type: Article

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