International Journal of Quantum Chemistry

Cover image for International Journal of Quantum Chemistry

Supplement: Proceedings of the International Symposium on Atomic, Molecular, and Solid-State Theory, Collision Phenomena, and Computational Quantum Chemistry

8/14 March 1981

Volume 20, Issue S15

Pages fmi–fmi, 1–727

  1. Masthead

    1. Top of page
    2. Masthead
    3. Articles
    4. Erratum
    5. Articles
    1. You have free access to this content
      Masthead (page fmi)

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200801

  2. Articles

    1. Top of page
    2. Masthead
    3. Articles
    4. Erratum
    5. Articles
    1. John Hasbrouck Van Vleck (1899–1980) (pages 1–3)

      E. Bright Wilson

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200802

    2. Bernd T. Matthias (pages 5–19)

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200803

    3. A unitary group formulation of open-shell electron propagator theory (page 63)

      Gregory Born and Isaiah Shavitt

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200807

    4. Invariance transformations and AGP optimization (pages 129–131)

      Richard L. Lozes, Brian Weiner and Yngve Öhrn

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200813

    5. An analysis of the AGP and projected AGP wavefunctions (pages 133–141)

      Erland Sangfelt, Osvaldo Goscinski, Nils Elander and Henry Kurtz

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200814

    6. On the energy optimization of the AGP wavefunction. The ground state of the Be atom (pages 143–149)

      Henry A. Kurtz, Nils Elander, Osvaldo Goscinski and Erland Sangfelt

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200815

    7. Additional new computational strategies for ab initio calculations on large molecules (pages 199–201)

      Joyce J. Kaufman, P. C. Hariharan and Herbert E. Popkie

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200821

    8. Symmetry dilemmas in oxocarbons (pages 219–224)

      D. P. Vercauteren, J. G. Fripiat and J. M. André

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200824

    9. New problems for ab-initio valence bond theory (pages 225–229)

      Massimo Simonetta, Mario Raimondi and Gian Franco Tantardini

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200825

    10. Nonempirical studies of the electronic properties of highly conducting polymers (pages 231–241)

      J. L. Brédas, R. R. Chance, R. H. Baughman and R. Silbey

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200826

    11. Multimode vibronic coupling effects in molecules (pages 251–267)

      L. S. Cederbaum, H. Köppel and W. Domcke

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200828

    12. Molecular orbital studies of vibrational frequencies (pages 269–278)

      J. A. Pople, H. B. Schlegel, R. Krishnan, D. J. Defrees, J. S. Binkley, M. J. Frisch, R. A. Whiteside, R. F. Hout and W. J. Hehre

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200829

    13. Lie algebra and molecular shell model. II (pages 305–320)

      Chia-Chung Sun, Bei-Foo Li and Au-Chin Tang

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200833

    14. Dispersion-equation approach to obtaining complex optical potentials for electron scattering (pages 341–353)

      Steven M. Valone, Devarajan Thirumalai and Donald G. Truhlar

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200836

    15. Theory and calculation of resonances using complex coordinates (pages 355–367)

      C. A. Nicolaides, Y. Komninos and TH. Mercouris

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200837

    16. Phase-coexistence in partially degenerate nuclear matter (pages 381–384)

      J. Robert Buchler and Manuel Barranco

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200839

    17. An exact one-electron model of atomic structure: The helium atom ground state (page 385)

      Chin Chui Tai and Geoffrey Hunter

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200840

    18. Electronic extracule densities (pages 393–400)

      Ajit J. Thakkar and Nancy J. Moore

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200842

    19. The variational cellular method for quantum mechanical applications: Calculations of the ground and excited states of F2 and Ne2 molecules (pages 401–408)

      José R. Leite, Adalberto Fazzio, Marco A. P. Lima, A. M. Dias, Abel Rosato and E. Segre

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200843

    20. Bonding in the MO2 transition-metal diatomic molecule (pages 429–435)

      Miguel Castro, Jaime Keller and Pilar Mareca

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200846

    21. On the theory of the KVV auger spectrum of Li (pages 437–443)

      Joel N. Schulman and John D. Dow

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200847

    22. MS-Xα: Treatment for native defects in GaSb (page 457)

      Luiz M. Brescansin and A. Fazzio

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200849

    23. Matrix elements in the analytic tetrahedron method (pages 459–468)

      N. E. Brener, J. L. Fry and R. A. Johnson

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200850

    24. Effects of the environment on frenkel core-exciton energies (pages 469–476)

      Otto F. Sankey, Roland E. Allen and John D. Dow

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200851

    25. Properties of narrow band insulators (pages 487–498)

      A. Barry Kunz

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200853

    26. Use of ATM in evaluating spin-density (pages 499–505)

      P. C. Pattnaik, J. L. Fry, N. E. Brener and G. Fletcher

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200854

    27. Magnetic polarons in magnetic semiconductors (pages 507–519)

      P. Kuivalainen, J. Sinkkonen and T. Stubb

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200855

  3. Erratum

    1. Top of page
    2. Masthead
    3. Articles
    4. Erratum
    5. Articles
    1. You have free access to this content
  4. Articles

    1. Top of page
    2. Masthead
    3. Articles
    4. Erratum
    5. Articles
    1. State densities and time delay in molecular collisions (pages 583–594)

      David Wardlaw and Paul Brumer

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200862

    2. Toward chemodynamics (pages 621–632)

      Kenichi Fukui, Akitomo Tachibana and Koichi Yamashita

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200865

    3. Kinetic equations for physisorption (pages 683–694)

      H. J. Kreuzer

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200871

    4. Generalized virial relations and the theory of subdynamics (pages 695–702)

      CH. Obcemea, P. Froelich and E. J. Brändas

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200872

    5. A new adiabatic approach to the photodissociation of polyatomic molecules (pages 703–714)

      Vladimir Z. Kresin and William A. Lester Jr.

      Version of Record online: 19 JUN 2009 | DOI: 10.1002/qua.560200873

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