References
- Hannay , N.B. 1976 . Treatise of Solid State Chemistry , Plenum .
- Ángyán , J. , Allavena , M. , Picard , M. , Pottier , A. and Tapia , O. 1982 . J. Chem. Phys. , 77 : 4723 – 4723 .
- Glaser , L. 1977 . Chem. Rev. , 75 : 21 – 21 .
- Pisani , C. , Dovesi , R. and Ugliengo , P. 1983 . Phys. Stat. Sol. (b) , 116 : 249 – 249 .
- Pisani , C. 1985 . Phil. Mag. , 51 : 89 – 89 .
- Kein , W. 1983 . Catalysis in C1 Chemistry , D. Reidel .
- Pisani , C. and Dovesi , R. 1980 . Int. J. quant. Chem. , 17 : 501 – 501 .
- Dovesi , R. , Pisani , C. , Roetti , C. and Saunders , V.R. 1983 . Phys. Rev. B , 28 : 5781 – 5781 .
- Ángyán , J.G. and Silvi , B. 1987 . J. chem. Phys. , 86 : 6957 – 6957 .
- Preuss , H. 1955 . Z. Naturf. (a) , 10 : 365 – 365 .
- Hay , P.J. , Wadt , W.R. and Kahn , L.R. 1978 . J. chem. Phys. , 68 : 3059 – 3059 .
- Sakai , Y. , Miyoshi , M. , Klobukowski , M. and Huzinaga , S. 1987 . J. comput. Chem. , 35 : 226 – 226 . 1987, Ibid., 35, 256.
- Dolg , M. , Wedig , U. , Stoll , H. and Preuss , H. 1987 . J. chem. Phys. , 86 : 866 – 866 .
- Barthelat , J.C. and Durand , P. 1978 . Gazz. chim. ital. , 108 : 225 – 225 .
- Topiol , S. unpublished results cited in GAUSSIAN 80 notice
- Binkley , J.S. , Whiteside , R.A. , Krishnan , R. , Seeger , R. , Defrees , H. , Schlegel , B. , Topiol , S. , Kahn , L.R. and Pople , J.A. 1981 . GAUSSIAN 80, Quant. Chem. Prog. Exch., Program No. 406
- Effective core potential or model potential parameters and valence orbitals were also determined systematically for main group elements Na to Bi Wadt W.R. Hay P.J. J. chem. Phys. 1985 82 284 284
- Hehre , W.J. , Ditchfield , R. and Pople , J.A. 1972 . J. chem. Phys. , 56 : 2257 – 2257 .
- Huzinaga , S. 1984 . Phys. Sci. Data , 16 (Elsevier)
- Durand , P. and Barthelat , J.C. 1975 . Theor. Chim. Acta (Berl.) , 38 : 283 – 283 .
- Barthelat , J.C. , Durand , P. and Serafini , A. 1977 . Molec. Phys. , 33 : 159 – 159 .
- Szasz , L. 1985 . Pseudopotential Theory of Atoms and Molecules , 170 – 172 . Wiley .
- Roos , B. , Salez , B. , Veillard , A. and Clementi , E. 1968 . A general program for calculations of atomic SCF orbitals by the expansion method. Special IBM technical report , San Jose, California : IBM Research Laboratory .
- Roetti , C. and Clementi , E. 1974 . J. chem. Phys. , 60 : 4725 – 4725 .
- Jeung , G.H. , Daudey , J.P. and Malrieu , J.P. 1983 . J. Phys. B , 16 : 699 – 699 .
- Seiti , K. private communication
- Pelissier , M. , Komiha , N. and Daudey , J.P. J. comput. Chem. , in the press