Journal of Computational Chemistry

Cover image for Journal of Computational Chemistry

Autumn (Fall) 1982

Volume 3, Issue 3

Pages fmi–fmi, 277–450

  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.540030301

  2. Articles

    1. Top of page
    2. Masthead
    3. Articles
    1. Calculation of macromolecular force constants (pages 297–304)

      B. F. Putnam and L. L. Van Zandt

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030304

    2. Planar and nonplanar vibrations of cytosine (pages 305–316)

      B. F. Putnam and L. L. Van Zandt

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030305

    3. Calculation of the average properties of atoms in molecules. II (pages 317–328)

      Friedrich W. Biegler-könig, Richard F. W. Bader and Ting-Hua Tang

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030306

    4. Structures of some fluorinated benzenes determined by ab initio computation (pages 344–353)

      James E. Boggs, Frank Pang and Péter Pulay

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030309

    5. Stabilization of methyl anions by first-row substituents. The superiority of diffuse function-augmented basis sets for anion calculations (pages 363–371)

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

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030311

    6. Spin–orbit and dispersion energy effects in XeF (pages 372–380)

      M. Krauss, W. J. Stevens and P. S. Julienne

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030312

    7. The conformation of pithomycolide (pages 381–384)

      David Hall, Nicola Pavitt and Murray K. Wood

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030313

    8. Principles for a direct SCF approach to LICAOMOab-initio calculations (pages 385–399)

      J. Almlöf, K. Faegri Jr. and K. Korsell

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030314

    9. Approaches to charge calculations in molecular mechanics (pages 407–416)

      Raymond J. Abraham, Lee Griffiths and Philip Loftus

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540030316

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