Works matching IS 01928651 AND DT 1984 AND VI 5 AND IP 3
Results: 12
Electron correlation and relative energetic characteristics of complex hydrides of light elements. I. Beryllohydrides.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 263, doi. 10.1002/jcc.540050310
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A directing effect of n-π* transitions on electronic charges.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 225, doi. 10.1002/jcc.540050303
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A quantum mechanical study of the equilibrium between 1,4- and 1,6-dialkylcyclooctatetraenes.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 248, doi. 10.1002/jcc.540050307
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Determination of reactivity by MO theory. 27. Molecular orbital study of the gas-phase decarboxylation of but-3-enoic acid.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 217, doi. 10.1002/jcc.540050302
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Molecular mechanics assessment of the configurational statistics of polyoxyethylene.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 241, doi. 10.1002/jcc.540050306
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Masthead.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. fmi, doi. 10.1002/jcc.540050301
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- Article
Use of molecular symmetry in two-electron integral transformation An MP2 program compatible with HONDO 5.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 280, doi. 10.1002/jcc.540050312
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A computational study of the reaction of methane with methyl radical.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 237, doi. 10.1002/jcc.540050305
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Molecular associations: Values of the expansion parameters for new classes of atoms.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 261, doi. 10.1002/jcc.540050309
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On searching neighbors in computer simulations of macromolecular systems.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 272, doi. 10.1002/jcc.540050311
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Evaluation of MNDO calculated proton affinities.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 230, doi. 10.1002/jcc.540050304
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A program for calculation of crystal conformations of flexible molecules using convergence acceleration.
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- Journal of Computational Chemistry, 1984, v. 5, n. 3, p. 252, doi. 10.1002/jcc.540050308
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- Article