Calculation of hyperfine tensors and paramagnetic NMR shifts using the relativistic zeroth-order regular approximation and density functional theory

Journal of Chemical Theory and Computation

Volumn 7, Issue 7, 2011, Pages 2175-2188

  Autschbach, Jochen ^a   Patchkovskii, Serguei ^b   Pritchard, Ben ^a  

^a UNIVERSITY AT BUFFALO   (United States)

^b NATIONAL RESEARCH COUNCIL CANADA   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 79960260056     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/ct200143w     Document Type: Article

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