International Journal of Quantum Chemistry

Cover image for International Journal of Quantum Chemistry

Supplement: Proceedings of the International Symposium on Atomic, Molecular, and Condensed Matter Theory and Computational Methods

12/19 February 1994

Volume 52, Issue S28

Pages fmi–fmi, 1–710

  1. Masthead

    1. Top of page
    2. Masthead
    3. Introduction
    4. Articles
    5. List of Participants
    1. Masthead (page fmi)

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520801

  2. Introduction

    1. Top of page
    2. Masthead
    3. Introduction
    4. Articles
    5. List of Participants
    1. You have free access to this content
      Introduction (pages 1–2)

      N. Y. Öhrn, J. R. Sabin and M. C. Zerner

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520802

  3. Articles

    1. Top of page
    2. Masthead
    3. Introduction
    4. Articles
    5. List of Participants
    1. Correlation and propagation in time (pages 7–10)

      Jan Linderberg

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520804

    2. Electron–Nuclear dynamics of molecular systems (pages 11–21)

      Agustín Diz and Yngve Öhrn

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520805

    3. Semidirect algorithms in electron propagator calculations (pages 23–27)

      V. G. Zakrzewski and J. V. Ortiz

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520806

    4. Evaluation of integrals appearing in the hylleraas CI method by expanding 1/rij in terms of a complete basis set (pages 39–48)

      J. E. Pérez, H. H. Cuenya, F. S. Ortiz, R. H. Contreras, H. Grinberg, C. G. Giribet and M. C. Ruiz De Azúa

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520808

    5. Self-Consistent coupling of atomic orbitals to a moving charge (pages 49–64)

      Herbert F. M. Da Costa and David A. Micha

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520809

    6. From parallel to distributed computing for reactive scattering calculations (pages 85–102)

      Antonio Laganà, Osvaldo Gervasi, Ranieri Baraglia and Domenico Laforenza

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520812

    7. The calculation of feshbach resonances using coupled propagator equations (pages 103–111)

      Hongbin Zhan, Yinchun Zhang and Peter Winkler

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520813

    8. Chemistry and phase transitions from hypervelocity impacts (pages 129–137)

      C. T. White, S. B. Sinnott, J. W. Mintmire, D. W. Brenner and D. H. Robertson

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520815

    9. The coupled cluster theory of quantum lattice systems (pages 155–172)

      Raymond F. Bishop and Yang Xian

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520817

    10. Influence of rotation on multiphoton processes in HF (pages 173–180)

      J. Broeckhove, B. Feyen and P. Van Leuven

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520818

    11. Effective core potential study of multiply bonded transition metal complexes of the heavier main group elements (pages 181–194)

      Michael T. Benson, Thomas R. Cundari, Yueping Li and Lynn A. Strohecker

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520819

    12. Topological analysis of valence electron charge distributions from semiempirical and ab initio methods (pages 215–226)

      Minhhuy HÔ, Hartmut Schmider, Kenneth E. Edgecombe and Vedene H. Smith Jr

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520822

    13. Franck–Condon factors and squeezed states (pages 261–264)

      A. Palma, L. Sandoval and M. Martín

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520827

    14. Energy depositions of protons in allotropic carbon ultrathin films (pages 299–308)

      Jin Z. Wu, S. B. Trickey, John R. Sabin and J. Nobel

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520831

    15. Multicavity SCRF calculation of ion hydration energies (pages 339–348)

      Geerd H. F. Diercksen, Mati Karelson, Toomas Tamm and Michael C. Zerner

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520834

    16. Quantum-Mechanical investigation of large water clusters (pages 349–360)

      Karl N. Kirschner and George C. Shields

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520835

    17. Solvent effects on the electronic spectrum of Reichardt's dye (pages 361–377)

      Ricardo Bicca De Alencastro, Joaquim D. Da Motta Neto and Michael C. Zerner

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520836

    18. Ab initio investigation of the static polarizability of planar and twisted infinite polythiophene chains (pages 451–467)

      David H. Mosley, Joseph G. Fripiat, Benoît Champagne and Jean-Marie André

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520842

    19. Elemental carbon isomerism (pages 501–523)

      D. J. Klein and X. Liu

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520845

    20. A note on the number of spanning trees in buckminsterfullerene (pages 525–528)

      Nenad Trinajstić, Zlatko Mihalić and Frank E. Harris

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520846

    21. Structural and electronic studies of Ga3As3, Ga4As3, and Ga3As4 (pages 571–577)

      P. Piquini, S. Canuto and A. Fazzio

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520851

    22. Diborane, Dialane, and Digallane: Accurate geometries and vibrational frequencies (pages 579–594)

      David H. Magers, R. Bryan Hood and Jerzy Leszczyński

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520852

    23. Relativistic density-functional studies of naked and ligated gold clusters (pages 595–610)

      Oliver D. Häberlen, Sai-Cheong Chung, Notker Rösch and Notker Rösch

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520853

    24. A density functional study of the interaction of CO2 with a Pd atom (pages 645–654)

      Suzanne Sirois, Miguel Castro and Dennis R. Salahub

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520857

    25. Electronic properties of multiple delta-doped layers in silicon and GaAs (pages 667–673)

      L. M. R. Scolfaro, D. Beliaev, J. R. Leite, A. T. Lino and E. K. Takahashi

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520859

    26. Quantum size effects in hexagonal aluminum films (pages 675–686)

      J. C. Boettger, U. Birkenheuer, N. Rösch and S. B. Trickey

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520860

    27. On the role of doping in high-Tc superconductors (pages 687–693)

      Changjiang Mei and Vedene H. Smith Jr

      Version of Record online: 21 SEP 2004 | DOI: 10.1002/qua.560520861

  4. List of Participants

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

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