Journal of Computational Chemistry

Cover image for Journal of Computational Chemistry

Autumn (Fall) 1983

Volume 4, Issue 3

Pages fmi–fmi, 283–448

  1. Masthead

    1. Top of page
    2. Masthead
    3. Articles
    1. Masthead (page fmi)

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040301

  2. Articles

    1. Top of page
    2. Masthead
    3. Articles
    1. Energetics and structure of the hydrated gaseous halide anions (pages 283–293)

      B. Thimme Gowda and Sidney W. Benson

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040302

    2. Efficient diffuse function-augmented basis sets for anion calculations. III. The 3-21+G basis set for first-row elements, Li–F (pages 294–301)

      Timothy Clark, Jayaraman Chandrasekhar, Günther W. Spitznagel and Paul Von Ragué Schleyer

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040303

    3. Molecular mechanics with an array processor (pages 313–332)

      Peter H. Berens and Kent R. Wilson

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040306

    4. Energetics of the neighbor exclusion model of intercalation (pages 333–336)

      Andrezej Sawaryn, Bernd Leps and Hans Bradaczek

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040307

    5. Theory of the radiative lifetime of the 3B1 state of SO2 (pages 337–344)

      Philip Phillips and Ernest R. Davidson

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040308

    6. Uracil–4-Hydroxyuracil tautomerism revisited (pages 345–349)

      Theresa Julia Zielinski

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040309

    7. Multicollinearity and some applications in biological chemistry (pages 362–365)

      R. Sanjeevi, R. Nagarajan and V. Sri Ram

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040311

    8. Intramolecular interaction effects and the structure of N2OS and N2O2: An Ab initio study (pages 379–389)

      Charles Bock, Mendel Trachtman, Ann Schmiedekamp, Philip George and Tin S. Chin

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040313

    9. Isotope effects in molecular mechanics (MM2). Calculations deuterium compounds (pages 399–403)

      Norman L. Allinger and Heather L. Flanagan

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040315

    10. A water-mediated tautomerism mechanism in formamide and amidine. An ab initio study (pages 419–427)

      Theresa Julia Zielinski, Raymond Alcide Poirier, Michael Roy Peterson and Imre G. Csizmadia

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540040318

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