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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 101, 2003 - Issue 1-2
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Original Articles

Non-orthogonal approaches to the study of magnetic interactions

R. BROER Theoretical Chemistry, Materials Science Centre, Rijksuniversiteit Groningen, Nijenborgh 4, 9747, AG Groningen, The Netherlands
,
L. HOZOI Theoretical Chemistry, Materials Science Centre, Rijksuniversiteit Groningen, Nijenborgh 4, 9747, AG Groningen, The Netherlands
&
W. C. NIEUWPOORT Theoretical Chemistry, Materials Science Centre, Rijksuniversiteit Groningen, Nijenborgh 4, 9747, AG Groningen, The Netherlands
Pages 233-240 | Received 24 Jan 2002, Accepted 22 Jul 2002, Published online: 25 Nov 2009

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Karin Fink & Volker Staemmler. (2013) A modified CAS-CI approach for an efficient calculation of magnetic exchange coupling constants. Molecular Physics 111:16-17, pages 2594-2605.
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A. Mitrushchenkov & H.-J. Werner. (2007) Calculation of transition moments between internally contracted MRCI wave functions with non-orthogonal orbitals† . Molecular Physics 105:9, pages 1239-1249.
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