Benzene adsorbed on Cu(110): Theoretical X-ray absorption, emission and shake calculations

Surface Science

Volumn 408, Issue 1-3, 1998, Pages 1-20

  Pettersson, L G M ^a   Agren H ^b   Luo, Y ^a,b,c   Triguero, L ^a  

^a STOCKHOLM UNIVERSITY   (Sweden)

^b LINKÖPING UNIVERSITY   (Sweden)

^c UNIVERSITY OF COPENHAGEN   (Denmark)

Author keywords

Ab initio quantum chemical methods and calculations; Adatoms; Aromatics; Copper; Density functional calculations; Near edge extended X ray absorption fine structure (NEXAFS); Soft X ray photoelectron spectroscopy; X ray emission

Indexed keywords

ADSORPTION; BENZENE; CHEMICAL BONDS; CHEMISORPTION; COMPUTATIONAL METHODS; CONFORMATIONS; CRYSTAL ORIENTATION; CRYSTAL SYMMETRY; ELECTROMAGNETIC WAVE EMISSION; PHOTONS; QUANTUM THEORY; X RAY PHOTOELECTRON SPECTROSCOPY;

ADATOMS; DENSITY FUNCTIONAL THEORY (DFT); NEAR EDGE EXTENDED X RAY ABSORPTION FINE STRUCTURE (NEXAFS) ANALYSIS;

COPPER;

EID: 0347566032     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(98)00085-5     Document Type: Article

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