By Kenneth B. Lipkowitz, Donald B. Boyd
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B. Schlegel, K. Raghavachari, J. S. Binkley, C. Gonzalez, D. J. Defrees, D. J. Fox, R. A. Whiteside, R. Seeger, C. F. Melius, J. Baker, R. L. Martin, L. R. Kahn, J. J. P. Stewart, E. M. Fluder, S. Topiol, and J. A. , Pittsburgh, PA. 11. P. R. Taylor, Int. J. , 31,521 (1987). Integral Processing in Beyond-HartreeFock Calculations. 12. M. Head-Gordon, J. A. Pople, and M. J. Frisch, Chem. Phys. , 153, 503 (1988). MP2 Energy Evaluation by Direct Methods. 13. 5. Saebr~and J. Almlof, Chem. Phys. , 154, 83 (1989).
V. Termath, W. Klopper, and W. Kutzelnigg,]. Chem. Wave Functions with Terms Linear in the Interelectronic Coordinates to Take Care of the Correlation Cusp. 11. Second-Order Maller-Plesset (MP2-Rl2) Calculations on Closed-Shell Atoms. W. Klopper and W. Kutzelnigg, J. Chem. , 94, 2020 (1991). Wave Functions with Terms Linear in the Interelectronic Coordinates to Take Care of the Correlation Cusp. 111. Second-Order Msller-Plesset (MP2-Rl2) Calculations on Molecules of First Row Atoms. 59. R. Jurgens-Lutovsky and J.
Hawkins, A. Meyer, T. A. Lewis, S. Loren, and F. J. Hollander, Science, 252, 312 (1991). Crystal Structure of Osmylated C,,,: Confirmation of the Soccer Ball Framework. 32 Ab lnitio Calculations on Larze Molecules 76. S. Liu, Y. J. Lu, M. M. Kappes, and J. A. Ibers, Science, 254,408 (1991). The Structure of the C,, Molecule: X-Ray Crystal Structure Determination of a Twin at 110 K. 77. A. H. H. Chang, W. C. Ermler, and R. M. Pitzer, J. Chem. , 95,9288 (1991). C,, and Its Ions: Electronic Structure, Ionization Potentials, and Excitation Energies.