Stephan P. A. Sauer

Stephan P. A. Sauer

Professor

ORCID: 0000-0003-4812-0522

Publication year:
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1 - 10 out of 13Page size: 10
  1. 2010
  2. Published

    Amendment: Analysis of Isotope Effects in NMR One-bond Indirect Nuclear Spin-spin Coupling Constants in Terms of Localized Molecular Orbitals (Phys. Chem. Chem. Phys., 2009, 11, 3987–3995)

    Provasi, P. F. & Sauer, Stephan P. A., 10 Nov 2010, In: Physical Chemistry Chemical Physics. 12, 45, p. 15132 1 p.

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

  3. Published

    Basis set effects on coupled cluster benchmarks of electronically excited states: CC3, CCSDR(3) and CC2

    Silva-Junior, M. R., Sauer, Stephan P. A., Schreiber, M. & Thiel, W., 2010, In: Molecular Physics. 108, 3 & 4, p. 453-465

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

  4. Published

    Benchmarking NMR indirect nuclear spin-spin coupling constants: SOPPA, SOPPA(CC2), and SOPPA(CCSD) versus CCSD

    Kjær, H., Sauer, Stephan P. A. & Kongsted, J., 2010, In: Journal of Chemical Physics. 133, 14, p. 144106 13 p.

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

  5. Published

    Benchmarks of electronically excited states: Basis set effects on CASPT2 results

    Silva-Junior, M. R., Schreiber, M., Sauer, Stephan P. A. & Thiel, W., 2010, In: Journal of Chemical Physics. 133, 17, p. 174318 13 p.

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

  6. Published

    Comparison of the Directional Characteristics of Swift Ion Excitation for Two Small Biomolecules: Glycine and Alanine

    Bruun-Ghalbia, S., Sauer, Stephan P. A., Oddershede, J. & Sabin, J. R., 2010, In: European Physical Journal D : Atomic, Molecular and Optical Physics. 60, p. 71-76

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

  7. Published

    Mean Excitation Energies and Energy Deposition Characteristics of Bio-Organic Molecules

    Bruun-Ghalbia, S., Sauer, Stephan P. A., Oddershede, J. & Sabin, J. R., 2010, In: Journal of Physical Chemistry B. 114, 1, p. 633-637

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

  8. Published

    Optimized Basis Sets for the calculation of Indirect Nuclear Spin-Spin Coupling Constants Involving the Atoms B, Al, Si, P and Cl

    Provasi, P. F. & Sauer, Stephan P. A., 2010, In: Journal of Chemical Physics. 133, 10 p.

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

  9. Published

    Rotational g-factor and spin-rotation constant of CH+

    Sauer, Stephan P. A., 2010, In: Journal of Chemical Physics. 133, 17, p. 171101 4 p.

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

  10. Published

    Stopping Power of Molecules for Fast Ions

    Sabin, J. R., Oddershede, J., Cabrera-Trujillo, R., Sauer, Stephan P. A., Deumens, E. & Öhrn, Y., 2010, In: Molecular Physics. 108, 21, p. 2891 - 2897

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

  11. Published

    Structural trends of 77Se-1H spin-spin coupling constants and conformational behavior of 2-substituted selenophenes

    Rusakov, Y. Y., Krivdin, L. B., Sauer, Stephan P. A., Levanova, E. P. & Levkovskaya, G. G., 2010, In: Magnetic Resonance in Chemistry. 48, 1, p. 44-52

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

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