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note
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i, the model allows negative spin populations.
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49
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84931270541
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Hansen, N. K.; Coppens, P. Acta Crystallogr., Sect. A 1978, 34, 909.
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Acta Crystallogr., Sect. A
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Hansen, N.K.1
Coppens, P.2
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52
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6944251055
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Moller, C.; Plesset, M. S. Phys. Rev. 1934, 46, 618. Shavitt, I. Methods of Configurational Interaction. In Modern Theoretical Chemistry; Shaefer, H. F., III, Ed.; Plenum Press: New York, 1977; Vol. 3, p 189.
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Phys. Rev.
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Moller, C.1
Plesset, M.S.2
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53
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0001198991
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Methods of Configurational Interaction
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Shaefer, H. F., III, Ed.; Plenum Press: New York
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Moller, C.; Plesset, M. S. Phys. Rev. 1934, 46, 618. Shavitt, I. Methods of Configurational Interaction. In Modern Theoretical Chemistry; Shaefer, H. F., III, Ed.; Plenum Press: New York, 1977; Vol. 3, p 189.
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Modern Theoretical Chemistry
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Shavitt, I.1
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55
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0345418638
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note
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36 The different calculations were done with the TZ94+P basis set.
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56
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0000216001
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Vosko, S. H.; Wilk, L.; Nausair, M. Can. J. Phys. 1980, 58, 1200.
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Can. J. Phys.
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Vosko, S.H.1
Wilk, L.2
Nausair, M.3
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