Advertisement

Electron correlation in the seventies

  • Pasquale v. Herigonte
Conference paper
Part of the Structure and Bonding book series (STRUCTURE, volume 12)

Keywords

Molecular Orbital Electron Correlation Correlation Energy Pair Distribution Function Rotation Barrier 
These keywords were added by machine and not by the authors. This process is experimental and the keywords may be updated as the learning algorithm improves.

Preview

Unable to display preview. Download preview PDF.

Unable to display preview. Download preview PDF.

References

  1. 1.
    Löwdin, P. O.: Advan. Chem. Phys. 2, 207 (1959).CrossRefGoogle Scholar
  2. 2.
    Silverstone, H. J., Joy, H. W.: J. Chem. Phys. 47, 1384 (1967).CrossRefGoogle Scholar
  3. 3.
    Switkes, E., Stevens, R. M., Lipscomb, W. N.: J. Chem. Phys. 51, 5229 (1969).CrossRefGoogle Scholar
  4. 4.
    Lehn, J. M.: In: Computational Problems in Quantum Chemistry, edited by G. Diercksen and A. Veillard, Max-Planck-Institut für Physik und Astrophysik, München (1969).Google Scholar
  5. 5.
    Rauk, A., Allen, L. C., Clementi, E.: J. Chem. Phys. 52, 4133 (1970).CrossRefGoogle Scholar
  6. 6.
    Pipano, A., Gilman, R. R., Bender, C. F., Shavitt, I.: Chem. Phys. Letters 4, 583 (1970).CrossRefGoogle Scholar
  7. 7.
    Kaldor, U., Shavit, I.: J. Chem. Phys. 45, 888 (1966).CrossRefGoogle Scholar
  8. 8.
    Shull, H., Löwdin, P. O.: J. Chem. Phys. 30, 617 (1959).CrossRefGoogle Scholar
  9. 9.
    Kutzelnigg, W., Ahlrichs, R., Labib-Iskander, I., Bingel, W.: Chem. Phys. Letters 1, 447 (1967).CrossRefGoogle Scholar
  10. 10.
    Munsch, B., Vinh, J.: (unpublished results).Google Scholar
  11. 11.
    Robb, M. A., Csizmadia, I. G.: Intern. J. Quant. Chem. 4, (365) (1970).CrossRefGoogle Scholar
  12. 12.
    Pitzer, R. M., Lipscomb, W. N.: J. Chem. Phys. 39, 1995 (1963).CrossRefGoogle Scholar
  13. 13.
    Lévy, B., Moireau, M. C.: J. Chem. Phys. 54, 3316 (1971).CrossRefGoogle Scholar
  14. 14.
    Klessinger, M.: Symp. Faraday Soc. 2, 73 (1969).CrossRefGoogle Scholar
  15. 15.
    Magnasco, V., Musso, G. F., Mc.Weeny, R.: J. Chem. Phys. 47, 4617 (1967).CrossRefGoogle Scholar
  16. 16.
    Veillard, A.: Chem. Phys. Letters 3, 128 (1969); 4, 51 (1970).CrossRefGoogle Scholar
  17. 17.
    Kołos, W., Roothaan, C. C. J.: Rev. Mod. Phys. 32, 211 (1960).CrossRefGoogle Scholar
  18. 18.
    Clementi, E.: Chem. Phys. 46, 3851 (1967).CrossRefGoogle Scholar
  19. 19.
    Snyder, L. C., Basch, H.: J. Am. Chem. Soc. 91, 2189 (1969).CrossRefGoogle Scholar
  20. 20.
    Gelus, M., Ahlrichs, R., Staemmler, V., Kutzelnigg, W.: Chem. Phys. Letters 7, 503 (1971).CrossRefGoogle Scholar
  21. 21.
    Das, G., Wahl, A. C.: J. Chem. Phys. 47, 2934 (1967).CrossRefGoogle Scholar
  22. 22.
    Gelus, M., Ahlrichs, R., Staemmler, V., Kutzelnigg, W.: Theoret. Chim. Acta. 21, 63 (1971).CrossRefGoogle Scholar
  23. 23.
    Kutzelnigg, W., Del Re, G., Berthier, G.: Forsch. Chem. Fors. 22, 1 (1971).Google Scholar
  24. 24.
    Møller, C., Plesset, M. S.: Phys. Rev. 46, 618 (1934).CrossRefGoogle Scholar
  25. 25.
    Nesbet, R. K.: Advan. Chem. Phys. 9, 321 (1965).CrossRefGoogle Scholar
  26. 26.
    Oziev, I., Yi, P. N., Khosla, A., Ramsey, N. F.: J. Chem. Phys. 46, 1530 (1967).Google Scholar
  27. 27.
    Huo, W. M.: J. Chem. Phys. 43, 624 (1965).CrossRefGoogle Scholar
  28. 28.
    Grimaldi, F., Lecourt, R., Moser, C.: Intern. J. Quant. Chem. 1S, 153 (1967).Google Scholar
  29. 29.
    Siu, A. K. Q., Davidson, E. R.: Intern. J. Quant. Chem. 4, 223 (1970).CrossRefGoogle Scholar
  30. 30.
    Green, S.: J. Chem. Phys. 52, 3100 (1970); 54, 827 (1971).CrossRefGoogle Scholar
  31. 31.
    Steward, R. F.: J. Chem. Phys. 53, 205 (1970).CrossRefGoogle Scholar
  32. 32.
    Coppens, P.: Science 158, 1577 (1967).CrossRefGoogle Scholar
  33. 33.
    Bender, C. F., Davidson, E. R.: Phys. Rev. 183, 23 (1969).CrossRefGoogle Scholar
  34. 34.
    Hiroike, E.: J. Phys. Soc. Japan 22, 379 (1967).CrossRefGoogle Scholar
  35. 35.
    Staemmler, V., Jungen, M.: (unpublished results).Google Scholar
  36. 36.
    Nesbet, R. K.: Coll. Int. C.N.R.S. 164, 87 (1967).Google Scholar
  37. 37.
    Kelly, H. P.: Phys. Rev. 173, 192 (1968).CrossRefGoogle Scholar
  38. 38.
    Dutta, N. C., Matsubara, C., Pu, R. T., Das, T. P.: Phys. Rev. Letters 21, 1139 (1968).CrossRefGoogle Scholar
  39. 39.
    Chang, E. S., Davidson, E. R., Vincow, G.: J. Chem. Phys. 52, 1740 (1970).CrossRefGoogle Scholar
  40. 40.
    Lefebvre. R.: In: Modern Quantum Chemistry, Part I, p. 215; edited by O. Sinanoğlu. New York: Academic Press (1965).Google Scholar
  41. 41.
    Millié, Ph., Lévy, B., Berthier, G.: Intern. J. quant. Chem. 6, 155 (1972).CrossRefGoogle Scholar
  42. 42.
    Ellinger, Y., Rassat, A., Subra, R., Berthier, G., Millie, Ph.: Chem. Phys. Letters 11, 362 (1971).CrossRefGoogle Scholar
  43. 43.
    Meyer, W.: J. Chem. Phys. 51, 5149 (1969).CrossRefGoogle Scholar
  44. 44.
    Kortzeborn, R. N.: I.B.M. Research Report RJ 577 (1969).Google Scholar
  45. 45.
    Arrighini, G. P., Tomasi, J., Guidotti, C.: Theoret. Chim. Acta. 18, 329 (1970).CrossRefGoogle Scholar
  46. 46.
    Dalgarno, A.: Advan. Phys. 11, 281 (1962).CrossRefGoogle Scholar
  47. 47.
    Stevens, R. M., Pitzer, R. M., Lipscomb, W. N.: J. Chem. PHys. 38, 550 (1963).CrossRefGoogle Scholar
  48. 48.
    Langhoff, P. W., Karplus, M., Hurst, R. P.: J. Chem. Phys. 44, 505 (1966).CrossRefGoogle Scholar
  49. 49.
    Pole, J. A., McIver, J. W., Jr., Ostlund, V. S.: J. Chem. Phys. 49, 2960 (1968).CrossRefGoogle Scholar
  50. 50.
    Arrighini, G. P., Tomasi, J., Petrangolo, C.: Theoret. Chim. Acta. 18, 341 (1970).CrossRefGoogle Scholar
  51. 51.
    Karplus, M., Anderson, D. H.: J. Chem. Phys. 30, 6 (1959).CrossRefGoogle Scholar
  52. 52.
    McConnell, H. M.: J. Chem. Phys. 24, 460 (1956).CrossRefGoogle Scholar
  53. 53.
    Lennard-Jones, J. E.: Proc. Roy. Soc. (London) A 202, 1, 14 (1949).Google Scholar
  54. 54.
    Meyer, W.: Z. Physik 229, 452 (1969).CrossRefGoogle Scholar
  55. 55.
    Barbier, C., Gagnaire, D., Levy, B., Berthier, G.: J. Magn. Res. 5, 11 (1971).Google Scholar
  56. 56.
    Das, T. P., Dutta, C. M., Dutta, N. C.: J. Physique 31, C 4–99 (1970).Google Scholar
  57. 57.
    Dalgarno, A., Stewart, A. L.: Proc. Roy. Soc. (London) A 238, 269 (1956); A 247 (1958); 257, 534 (1960).Google Scholar
  58. 58.
    Hall, G. G.: Advan. Quant. Chem. 1, 241 (1964).Google Scholar
  59. 59.
    Hirschfelder, J. O., Byers-Brown, W., Epstein, S. T.: Advan. Quant. Chem. 1, 255 (1964).Google Scholar
  60. 60.
    Sinanoğlu, O.: Proc. Natl. Acad. Sci. 47, 1217 (1961); Advan. Chem. Phys. 6, 315 (1964).CrossRefGoogle Scholar
  61. 61.
    Laforgue, A.: Compt. Rend. Acad. Sci. 238, 1933 (1954); Thèse Revue Opt. Theo. Exp., Paris (1955).Google Scholar
  62. 62.
    McWeeny, R., Kutzelnigg, W.: Intern. J. Quant. Chem. 2, 187 (1968).CrossRefGoogle Scholar
  63. 63.
    Levy, B., Kochanski, E.: Theoret. Chim. Acta. 12, 150 (1968).CrossRefGoogle Scholar
  64. 64.
    Daudey, J. P., Pullman, A.: Chem. Phys. Letters 5, 347 (1970).CrossRefGoogle Scholar
  65. 65.
    Chase, R. L., Kelly, H. P., Kohler, H. S.: Phys. Rev. 3, 1550 (1971).CrossRefGoogle Scholar
  66. 66.
    Meyer, W.: (unpublished results).Google Scholar
  67. 67.
    Pauzat, F., Ridard, J., Levy, B.: Mol. Phys. (1972).Google Scholar
  68. 68.
    Löwdin, P. O.: Phys. Rev. 97, 1474 (1955).CrossRefGoogle Scholar
  69. 69.
    McWeeny, R.: Proc. Roy. Soc. (London) A 253, 242 (1959).CrossRefGoogle Scholar
  70. 70.
    Rev. Mod. Phys. 32, 335 (1960); Intern. J. Quant. Chem. 1 S, 351 (1967).CrossRefGoogle Scholar
  71. 71.
    Slater, J. C.: Phys. Rev. 81, 385 (1951).CrossRefGoogle Scholar
  72. 72.
    Maslen, V. W.: Proc. Phys. Soc. (London) A 69, 734 (1956).CrossRefGoogle Scholar
  73. 73.
    Jørgensen, C. K.: Modern Aspects of Ligand Field Theory. Amsterdam: North-Holland 1971. Solid State Physics, 13, 375 (1962); Orbitals in Atoms and Molecules, Academic Press, London, 1962; Oxidation Numbers and Oxidation States, Springer Verlag, Berlin, 1969.Google Scholar
  74. 74.
    Suard, M., Jouhet, G.: Atti. Soc. Nat. (Modena) 100, 59 (1969).Google Scholar
  75. 75.
    Kutzelnigg, W., Del Re, G., Berthier, G.: Phys. Rev. 172, 49 (1968).CrossRefGoogle Scholar
  76. 76.
    Bingel, W. A.: Chem. Phys. Letters 5, 367 (1970).CrossRefGoogle Scholar
  77. 77.
    Claverie, P., Diner, S., Malrieu, J. P.: Intern. J. Quant. Chem. 1, 751 (1967); Theoret. Chim. Acta 8, 390 (1967); 13, 1, 18 (1969).Google Scholar
  78. 78.
    Epstein, S. T.: J. Chem. Phys. 42, 2897 (1965).CrossRefGoogle Scholar
  79. 79.
    Dickson, R. J., Sokoloff, J.: Phys. Rev. 141, 32 (1966).CrossRefGoogle Scholar
  80. 80.
    Byron, F. W., Joachim, C. J.: Phys. Rev. 146, 1 (1966).CrossRefGoogle Scholar
  81. 81.
    Pipano, A., Shavitt, I.: Intern. J. Quant. Chem. 2, 741 (1968).CrossRefGoogle Scholar
  82. 82.
    Whitten, J. L., Hackmeyer, M.: J. Chem. Phys. 51, 5584 (1969).CrossRefGoogle Scholar
  83. 83.
    Ahlrichs, R., Kutzelnigg, W.: J. Chem. Phys. 48, 1819 (1968). Theoret. Chim. Acta 10, 377 (1968); Chem. Phys. Letters 1, 651 (1968).CrossRefGoogle Scholar
  84. 84.
    Jungen, M., Ahlrichs, R.: Theoret. Chim. Acta 17, 339 (1970).CrossRefGoogle Scholar
  85. 85.
    Kutzelnigg, W.: Proceedings of the IBM Symposium on Molecular Physics, Ludwigsburg (1970).Google Scholar
  86. 86.
    Brillouin, L.: Actualités Scientifiques No 17, Hermann, Paris (1933).Google Scholar
  87. 87.
    Berthier, G., Meyer, A. Y., Praud, L.: Jerusalem Symp. Quant. Chem. Biochem. 3, 174 (1971).Google Scholar
  88. 88.
    Lévy, B.: Chem. Phys. Letters 4, 17 (1969); Intern. J. Quant. Chem. 4, 297 (1970).CrossRefGoogle Scholar
  89. 89.
    McWeeny, R.: Faraday Soc. Symp. 2, 7 (1968).CrossRefGoogle Scholar
  90. 90.
    Lévy, B.: (unpublished results).Google Scholar
  91. 91.
    Mukherjee, N. G., McWeeny, R.: Intern. J. Quant. Chem. 4, 97 (1970).CrossRefGoogle Scholar
  92. 92.
    Löwdin, P. O.: Phys. Rev. 97, 1474 (1955).CrossRefGoogle Scholar
  93. 93.
    Kutzelnigg, W.: Theoret. Chim. Acta. 1, 343 (1963).CrossRefGoogle Scholar
  94. 94.
    Bender, C. F., Davidson, E. R.: J. Phys. Chem. 70, 2675 (1966).CrossRefGoogle Scholar
  95. 95.
    Edmiston, C., Krauss, M.: J. Chem. Phys. 45, 1833 (1966); 49, 192 (1968).CrossRefGoogle Scholar
  96. 96.
    Boys, S. F.: Proc. Roy. Soc. (London) A 309, 195 (1969).Google Scholar
  97. 97.
    —, Handy, N. C.: Proc. Roy. Soc. (London) A 311, 309 (1969).Google Scholar
  98. 98.
    Longuet-Higgins, H. C.: In: quantum Theory of Atoms, Molecules and the Solid State, p. 105; edited by P. O. Löwdin. New York: Academic Press 1966.Google Scholar
  99. 99.
    Del Re, G., Parr, R. G.: Rev. Mod. Phys. 35, 604 (1963).CrossRefGoogle Scholar
  100. 100.
    — CECAM Symposium, Paris (1970).Google Scholar
  101. 101.
    Pines, D.: Elementary Excitations in Solids. New York: Benjamin 1963.Google Scholar
  102. 102.
    Čižek, J.: Advan. Chem. Phys. 14, 35 (1968).Google Scholar
  103. 103.
    Tolmachev, V. V.: Advan. Chem. Phys. 14, 421 (1968).CrossRefGoogle Scholar

Copyright information

© Springer-Verlag 1972

Authors and Affiliations

  • Pasquale v. Herigonte
    • 1
  1. 1.European Group of Theoretical Molecular Physics (EGTMP)RomaItalia

Personalised recommendations