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Sutton, L. E , Ed. Supplement 1956-1959, Special publication No. 18; Chemical Society: London
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9344224511
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O'Keeffe, M., Navrotsky, A., Eds.; Academic: New York
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Shannon, R.D.1
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Allen, F. H.; Kennard, O.; Watson, D. G.; Brammer, L.; Orpen, A. G.; Taylor, R. 1987, J. Chem. Soc., Perkin Trans. 2, S1.
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For atomic and ionic radii, see Gibbs, G. V.; Tamada, O.; Boisen, M. B., Jr. Phys. Chem. Minerals 1997, 24, 432 and references therein.
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Gaussian 98, Revision A.3, Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A., Jr.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B ; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B ; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I., Gomperts, R., Martin, R. L., Fox, D. J., Keith, T., Al-Laham, M. A; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M ; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Andres, J. L.; Gonzalez, C.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian, Inc , Pittsburgh, PA, 1998.
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Frisch, M.J.1
Trucks, G.W.2
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Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery Jr., J.A.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Gonzalez, C.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Gonzalez, C.55
Head-Gordon, M.56
Replogle, E.S.57
Pople, J.A.58
more..
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35
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43949164303
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f-Polarization functions are taken from Ehlers, A. W.; Bohme, M.; Dapprich, S.; Gobbi, A.; Hollwarth, A.; Jonas, V.; Kohler, K. F.; Stegmann, R ; Veldkamp, A.; Frenking, G. Chem. Phys. Lett. 1993, 208, 111.
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Ehlers, A.W.1
Bohme, M.2
Dapprich, S.3
Gobbi, A.4
Hollwarth, A.5
Jonas, V.6
Kohler, K.F.7
Stegmann, R.8
Veldkamp, A.9
Frenking, G.10
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37
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4043109855
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See also for studies of relativistic effects on bond length contractions (b) Pyykkö, P.; Desclaux, J. P. Chem. Phys. 1978, 34, 261.
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Chem. Phys.
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Pyykkö, P.1
Desclaux, J.P.2
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45
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0004166732
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Burgi, H.-B., Dunitz, J. D , Eds.; VCH: Tokyo, Appendix A
-
The d values used here are taken from the compilation of typical interatomic distances by Orpen, A. G.; Brammer, L.; Allen, F. H.; Kennard, O.; Watson, D. G.; Taylor, R. In Structure correlation; Burgi, H.-B., Dunitz, J. D , Eds.; VCH: Tokyo, 1994; Vol. 2, Appendix A.
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Structure Correlation
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Orpen, A.G.1
Brammer, L.2
Allen, F.H.3
Kennard, O.4
Watson, D.G.5
Taylor, R.6
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