Strong double excitation and open-shell features in the near-edge x-ray absorption fine structure spectroscopy of ferrocene and ferrocenium compounds

Journal of Chemical Physics

Volumn 131, Issue 11, 2009, Pages

  Otero, Edwige ^a,c   Kosugi, Nobuhiro ^b   Urquhart, Stephen G ^a  

^a UNIVERSITY OF SASKATCHEWAN   (Canada)

^b INSTITUTE FOR MOLECULAR SCIENCE   (Japan)

^c SYNCHROTRON SOLEIL   (France)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; CLOSED SHELLS; CONFIGURATION-INTERACTION CALCULATIONS; COVALENT BONDING; DOUBLE EXCITATIONS; ELECTRON CONFIGURATION; FERROCENES; FERROCENIUM; HARTREE-FOCK; HEXAFLUOROPHOSPHATES; METAL INTERACTIONS; NEAR EDGE X-RAY ABSORPTION FINE STRUCTURE SPECTROSCOPIES; NEAR-EDGE X-RAY ABSORPTION FINE STRUCTURE SPECTRUM; OPEN-SHELL;

ABSORPTION; ELECTRONS; IRON COMPOUNDS; SHELLS (STRUCTURES); X RAY ABSORPTION; X RAY ABSORPTION FINE STRUCTURE SPECTROSCOPY;

ABSORPTION SPECTROSCOPY;

EID: 72949104526     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3230101     Document Type: Article

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