Journal of Computational Chemistry

Cover image for Journal of Computational Chemistry

Summer 1980

Volume 1, Issue 2

Pages fmi–fmi, 111–203

  1. Masthead

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

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010201

  2. Articles

    1. Top of page
    2. Masthead
    3. Articles
    1. The C4H4CO potential surface. Reactions involving bicyclo[2.1.0]pentenone (pages 129–133)

      Armin Schweig and Walter Thiel

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010204

    2. Conformational energy surfaces of triplet-state isomeric methyloxiranes (pages 141–148)

      G. R. Demaré, M. R. Peterson, I. G. Csizmadia and O. P. Strausz

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010206

    3. Graph theoretical characterization and computer generation of certain carcinogenic benzenoid hydrocarbons and identification of bay regions (pages 149–157)

      K. Balasubramanian, Joyce J. Kaufman, Walter S. Koski and Alexandru T. Balaban

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010207

    4. A theoretical study of paths for decomposition and rearrangement of dihydroxycarbene (pages 158–166)

      David Feller, Weston Thatcher Borden and Ernest R. Davidson

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010208

    5. A note on density matrix extrapolation and multiple solutions of the unrestricted Hartree–Fock equations (pages 178–180)

      P. G. Mezey, O. P. Strausz and R. K. Gosavi

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010210

    6. The torsional potential function for n-butane (pages 181–184)

      N. L. Allinger and S. Profeta Jr

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010211

    7. The barrier to internal rotation in Ge2H6 (pages 185–188)

      Alan Hinchliffe

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010212

    8. The structure of carbon trioxide (pages 199–203)

      John A. Pople, Ute Seeger, Rolf Seeger and Paul V. R. Schleyer

      Article first published online: 7 SEP 2004 | DOI: 10.1002/jcc.540010215

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