Accurate Electric Field Gradients for the Coinage Metal Chlorides Using the PCNQM Method

International Journal of Quantum Chemistry

Volumn 76, Issue 3, 2000, Pages 371-384

  Pernpointner, Markus ^a   Schwerdtfeger, Peter ^a   Hess, Bernd A ^b  

^a UNIVERSITY OF AUCKLAND   (New Zealand)

^b UNIVERSITY OF BONN   (Germany)

Author keywords

Coinage metals; Coupled cluster; PCNQM model; Picture change effects; Relativistic effects

Indexed keywords

EID: 0001347181     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1097-461X(2000)76:3<371::AID-QUA6>3.0.CO;2-X     Document Type: Article

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