Journal of Computational Chemistry

Cover image for Journal of Computational Chemistry

September 1992

Volume 13, Issue 7

Pages fmi–fmi, 793–918

  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.540130701

  2. Articles

    1. Top of page
    2. Masthead
    3. Articles
    1. Conformational analysis of carbonyl and thiocarbonyl ethyl esters: The HC([DOUBLE BOND]X) (X, Y = O or S) internal rotation (pages 799–809)

      R. Fausto, L.A.E. Batista De Carvalho and J.J.C. Teixeira-Dias

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130703

    2. Stiffness-Adaptive Taylor method for the integration of non-stiff and stiff kinetic models (pages 810–820)

      J. J. Baeza Baeza, G. Ramis Ramos and F. Pérez Plá

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130704

    3. Vibrational Stark effect: Theoretical determination through the semiempirical AM1 method (pages 821–829)

      Josep Martí, Agustí Lledós, Juan Bertrán and Miquel Duran

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130705

    4. NDDO fragment self-consistent field approximation for large electronic systems (pages 830–837)

      György G. Ferenczy, Jean-Louis Rivail, Péter R. Surján and Gábor Náray-Szabó

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130706

    5. Heats of formation of organic molecules by Ab Initio calculations: Carboxylic acids and esters (pages 838–841)

      Norman L. Allinger, Lawrence R. Schmitz, Ioan Motoc, Charles Bender and Jan K. Labanowski

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130707

    6. Semiempirical study of compounds with O-H[BOND]O intramolecular hydrogen bond (pages 860–866)

      Miguel A. Ríos and JesúS Rodríguez

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130710

    7. Semiempirical study of electronic and bonding properties of cobalt silicide clusters (pages 867–873)

      German Urbina-Villalba, Leonardo J. Rodriguez, German R. Castro and Fernando Ruette

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130711

    8. Torsional energy levels and wave functions (pages 874–882)

      Alice Chung-Phillips

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130712

    9. Electronegativity and Bader's bond critical point (pages 912–918)

      Sanchita Hati and Dipankar Datta

      Version of Record online: 7 SEP 2004 | DOI: 10.1002/jcc.540130716

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