Origin of the paramagnetic properties of the mixed-valence polyoxometalate [GeV14o40]8- reduced by two electrons: wave function theory and model hamiltonian calculations

European Journal of Inorganic Chemistry

Volumn , Issue 34, 2009, Pages 5109-5114

  Suaud, N ^a   Masaro, Y ^a   Coronado, E ^b   Clemente Juan, J M ^b   Guihery N ^a  

^a CNRS   (France)

^b UNIVERSITY OF VALENCIA   (Spain)

Author keywords

Ab initio calculations; Electron transfer; Magnetic properties; Mixed valent compounds; Polyoxometalates

Indexed keywords

ELECTRON TRANSITIONS; HAMILTONIANS; MAGNETIC COUPLINGS; OXIDES; WAVE FUNCTIONS;

AB INITIO CALCULATIONS; ELECTRON TRANSFER; ELECTRON WAVE FUNCTIONS; MIXED VALENCE; MIXED-VALENT COMPOUNDS; MODEL HAMILTONIANS; PARAMAGNETIC PROPERTIES; POLYOXOMETALATES; UNPAIRED ELECTRONS; WAVE FUNCTION THEORY;

MAGNETIC PROPERTIES;

EID: 72949117019     PISSN: 14341948     EISSN: 10990682     Source Type: Journal    
DOI: 10.1002/ejic.200900803     Document Type: Article

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