Stephan P. A. Sauer

Stephan P. A. Sauer

Professor

ORCID: 0000-0003-4812-0522

Publication year:
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71 - 80 out of 259Page size: 10
  1. 2005
  2. Published

    Calculations of Dipole and Quadrupole Polarizability Radial Functions for LiH and HF: A Comparison of Different Linear Response Methods

    Paidarová, I. & Sauer, Stephan P. A., 2005, In: Advances in Quantum Chemistry. 48, p. 185-208

    Research output: Contribution to journal › Journal article › Research › peer-review

  3. Published

    Interaction energies and NMR indirect nuclear spin-spin coupling constants in linear HCN and HNC complexes

    Provasi, P. F., Aucar, G. A., Sanchez, M., Alkorta, I., Elguero, J. & Sauer, Stephan P. A., 2005, In: Journal of Physical Chemistry A. 109, 29, p. 6555-6564

    Research output: Contribution to journal › Journal article › Research › peer-review

  4. Published

    On the Usage of Locally Dense Basis Sets in the Calculation of NMR Indirect Nuclear Spin-Spin Coupling Constants: Vicinal Fluorine-Fluorine Couplings

    Sanchez, M., Provasi, P. F., Aucar, G. A. & Sauer, Stephan P. A., 2005, In: Advances in Quantum Chemistry. 48, p. 161-183

    Research output: Contribution to journal › Journal article › Research › peer-review

  5. Published

    Quantum-Chemical Calculations of Radial Functions for Rotational and Vibrational g Factors, Electric Dipolar Moment and Adiabatic Corrections to the Potential Energy for Analysis of Spectra of HeH+

    Sauer, Stephan P. A., Jensen, H. J. A. & Ogilvie, J. F., 2005, In: Advances in Quantum Chemistry. 48, p. 319-334

    Research output: Contribution to journal › Journal article › Research › peer-review

  6. Published

    The Rotational g Tensor of HF, H2O, NH3, and CH4: A Comparison of Correlated Ab Initio Methods

    Sauer, Stephan P. A., 2005, In: Advances in Quantum Chemistry. 48, p. 469-490

    Research output: Contribution to journal › Journal article › Research › peer-review

  7. Published

    The vibrational g-factor of dihydrogen from theoretical calculation and analysis of vibration-rotational spectra

    Bak, K. L., Sauer, Stephan P. A., Oddershede, J. & Ogilvie, J. F., 2005, In: Physical Chemistry Chemical Physics. 7, p. 1747-1758

    Research output: Contribution to journal › Journal article › Research › peer-review

  8. 2006
  9. Published

    Directional Dependence of the Mean Excitation Energy and Spectral Moments of the Dipole Oscillator Strength Distribution of Glycine and Its Zwitterion

    Sauer, Stephan P. A., Oddershede, J. & Sabin, J. R., 2006, In: Journal of Physical Chemistry A. 110, 28, p. 8811 -8817

    Research output: Contribution to journal › Journal article › Research › peer-review

  10. Published

    On the Angular Dependence of the Vicinal Fluorine-Fluorine Coupling Constant in 1,2-Difluoroethane: Deviation from a Karplus-like Shape

    Provasi, P. F. & Sauer, Stephan P. A., 2006, In: Journal of Chemical Theory and Computation. 2, 4, p. 1019-1027

    Research output: Contribution to journal › Journal article › Research › peer-review

  11. Published

    Two-photon absorption cross sections: An investigation of the accuracy of calculated absolute and relative values

    Nielsen, C. B., Rettrup, S. & Sauer, Stephan P. A., 2006, In: Journal of Chemical Physics. 124, 11, p. 114108

    Research output: Contribution to journal › Journal article › Research › peer-review

  12. 2007
  13. Published

    Correlated Linear Response Calculations of the C6 Dispersion Coefficients of Hydrogen Halides

    Sauer, Stephan P. A. & Paidarová, I., 2007, In: Computing Letters. 3, 2-4, p. 399-421 23 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

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