An indirect approach to the determination of the nuclear quadrupole moment by four-component relativistic DFT in molecular calculations

Chemical Physics Letters

Volumn 442, Issue 4-6, 2007, Pages 233-237

  Belpassi, Leonardo ^a   Tarantelli, Francesco ^a   Sgamellotti, Antonio ^a   Götz, Andreas W ^b   Visscher, Lucas ^b  

^a UNIVERSITY OF PERUGIA   (Italy)

^b VU UNIVERSITY AMSTERDAM   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; ELECTRIC FIELDS;

ELECTRIC FIELD GRADIENT (EFG); NUCLEAR QUADRUPOLE MOMENT;

MOLECULAR PHYSICS;

EID: 34347338610     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2007.05.108     Document Type: Article

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