Ab initio and DFT modelling of complex materials: Towards the understanding of electronic and magnetic properties of polyoxometalates

Chemical Society Reviews

Volumn 32, Issue 5, 2003, Pages 297-308

  Poblet, Josep M ^a   López, Xavier ^a   Bo, Carles ^a  

^a UNIVERSITAT ROVIRA I VIRGILI   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ANION; CHEMICAL COMPOUND; POLYOXOMETALATE DERIVATIVE; TRANSITION ELEMENT; UNCLASSIFIED DRUG;

COMPLEX FORMATION; COMPUTER; DENSITY FUNCTIONAL THEORY; ELECTRONICS; MAGNETISM; OXIDATION; QUANTUM CHEMISTRY; REVIEW;

EID: 1542619332     PISSN: 03060012     EISSN: 14604744     Source Type: Journal    
DOI: 10.1039/b109928k     Document Type: Article

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