International Journal of Quantum Chemistry

Cover image for International Journal of Quantum Chemistry

May 2009

Volume 109, Issue 6

Pages 1159–1417

  1. Theoretical and Computational Developments

    1. Top of page
    2. Theoretical and Computational Developments
    3. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    4. Properties, Dynamics, and Electronic Structure of Atoms
    5. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    6. Properties, Dynamics, and Electronic Structure of Condensed Systems and Clusters
    7. Theoretical Biochemistry and Biophysics
    1. Some considerations about Gaussian basis sets for electric property calculations (pages 1189–1199)

      Priscilla M. Arruda, A. Canal Neto and F. E. Jorge

      Version of Record online: 8 JAN 2009 | DOI: 10.1002/qua.21934

    2. Accurate solutions for the spiked oscillators (pages 1267–1273)

      G. Campoy and N. Aquino

      Version of Record online: 21 NOV 2008 | DOI: 10.1002/qua.21949

  2. Properties, Dynamics, and Electronic Structure of Atoms and Molecules

    1. Top of page
    2. Theoretical and Computational Developments
    3. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    4. Properties, Dynamics, and Electronic Structure of Atoms
    5. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    6. Properties, Dynamics, and Electronic Structure of Condensed Systems and Clusters
    7. Theoretical Biochemistry and Biophysics
  3. Properties, Dynamics, and Electronic Structure of Atoms

    1. Top of page
    2. Theoretical and Computational Developments
    3. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    4. Properties, Dynamics, and Electronic Structure of Atoms
    5. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    6. Properties, Dynamics, and Electronic Structure of Condensed Systems and Clusters
    7. Theoretical Biochemistry and Biophysics
  4. Properties, Dynamics, and Electronic Structure of Atoms and Molecules

    1. Top of page
    2. Theoretical and Computational Developments
    3. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    4. Properties, Dynamics, and Electronic Structure of Atoms
    5. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    6. Properties, Dynamics, and Electronic Structure of Condensed Systems and Clusters
    7. Theoretical Biochemistry and Biophysics
    1. Theoretical investigation of the formation of the tropylium ion from the toluene radical cation (pages 1322–1327)

      Kenneth W. Bullins, Thomas T. S. Huang and Scott J. Kirkby

      Version of Record online: 8 JAN 2009 | DOI: 10.1002/qua.21956

    2. Elongation method for calculating excited states of aromatic molecules embedded in polymers (pages 1328–1340)

      Vladimir Pomogaev, Feng Long Gu, Anna Pomogaeva and Yuriko Aoki

      Version of Record online: 14 JAN 2009 | DOI: 10.1002/qua.21965

  5. Properties, Dynamics, and Electronic Structure of Condensed Systems and Clusters

    1. Top of page
    2. Theoretical and Computational Developments
    3. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    4. Properties, Dynamics, and Electronic Structure of Atoms
    5. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    6. Properties, Dynamics, and Electronic Structure of Condensed Systems and Clusters
    7. Theoretical Biochemistry and Biophysics
    1. Pressure effects on the structural, electronic, and optical properties of Sin@SWCNTs (pages 1385–1395)

      Y. H. Zhang, J. Meng, X. Q. Zhang, Hui Li and C. A. Taft

      Version of Record online: 21 NOV 2008 | DOI: 10.1002/qua.21946

    2. Theoretical study on the interlay of hydrogen bonds in the trimers involving HCN and water (pages 1396–1402)

      Qingzhong Li, Xilin Wang, Jianbo Cheng, Wenzuo Li, Baoan Gong and Jiazhong Sun

      Version of Record online: 14 JAN 2009 | DOI: 10.1002/qua.21958

  6. Theoretical Biochemistry and Biophysics

    1. Top of page
    2. Theoretical and Computational Developments
    3. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    4. Properties, Dynamics, and Electronic Structure of Atoms
    5. Properties, Dynamics, and Electronic Structure of Atoms and Molecules
    6. Properties, Dynamics, and Electronic Structure of Condensed Systems and Clusters
    7. Theoretical Biochemistry and Biophysics
    1. Density functional theory study on the ionization potentials and electron affinities of thymine–formamide complexes (pages 1410–1417)

      Haitao Sun, Ke Tang, Yanmin Li, Chunfang Su, Zhengyu Zhou and Zhizhong Wang

      Version of Record online: 8 JAN 2009 | DOI: 10.1002/qua.21951

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