Stephan P. A. Sauer

Stephan P. A. Sauer

Professor

ORCID: 0000-0003-4812-0522

Publication year:
All
21 - 30 out of 259Page size: 10
  1. 2023
  2. Published

    A theoretical study of hydrogen abstraction reactions inguanosine and uridine

    Schaltz, K. F. & Sauer, Stephan P. A., 3 May 2023, In: International Journal of Molecular Sciences (Online). 24, 9, 12 p., 8192.

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

  3. Published

    Indirect nuclear spin-spin couplings with third order contributions added to the SOPPA method

    Sanz Rodrigo, J., Hillers-Bendtsen, Andreas Erbs, Kjeldal, F. Ø., Høyer, N. M., Mikkelsen, Kurt Valentin & Sauer, Stephan P. A., 28 Mar 2023, In: The Journal of Chemical Physics. 158, 12, 10 p., 124118.

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

  4. Published

    A Combined Experimental and Theoretical Study of ESR Hyperfine Coupling Constants for N,N,N’,N’-Tetrasubstituted p-Phenylenediamine Radical Cations

    Gleeson, R., Andersen, C. L., Rapta, P., Machata, P., Christensen, Jørn Bolstad, Hammerich, Ole & Sauer, Stephan P. A., 8 Feb 2023, In: International Journal of Molecular Sciences (Online). 24, 4, 17 p., 3447.

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

  5. Published

    13C NMR Chemical Shifts of Saccharides in the Solid State: A Density Functional Theory Study

    Moustafa, H., Larsen, F. H., Madsen, Anders Østergaard & Sauer, Stephan P. A., 2023, In: Magnetochemistry. 9, 8, 15 p., 192.

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

  6. Published

    Calculation of electric field gradients in Cd(II) model complexes of the CueR protein metal site

    O'Shea, C. A., Fromsejer, R., Sauer, Stephan P. A., Mikkelsen, Kurt Valentin & Hemmingsen, Lars Bo Stegeager, 2023, In: Physical Chemistry Chemical Physics. 25, p. 12277-12283 7 p.

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

  7. Published

    The importance of solvent effects in calculations of NMR coupling constants at the doubles corrected Higher Random-Phase Approximation

    Jessen, L. M., Reinholdt, P., Kongsted, J. & Sauer, Stephan P. A., 2023, In: Magnetochemistry. 9, 4, 14 p., 102.

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

  8. 2022
  9. Published

    Implicit and explicit solvent models have opposite effects on radiation damage rate constant for thymine

    Sørensen, Lea Northcote & Sauer, Stephan P. A., 21 Sep 2022, In: Advances in Quantum Chemistry. 85, p. 245-265 21 p.

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

  10. Published

    Magnesium(II)‐ATP Complexes in 1‐Ethyl‐3‐Methylimidazolium Acetate Solutions Characterized by 31Mg β‐Radiation‐Detected NMR Spectroscopy

    Mcfadden, R. M. L., Szunyogh, D., Bravo-frank, N., Chatzichristos, A., Dehn, M. H., Fujimoto, D., Jancsó, A., Johannsen, S., Kálomista, I., Karner, V. L., Kiefl, R. F., Larsen, F. H., Lassen, J., Levy, C. D. P., Li, R., Mckenzie, I., Mcphee, H., Morris, G. D., Pearson, M. R., Sauer, S. P. A. & 5 others, Sigel, R. K. O., Thulstrup, Peter Waaben, Macfarlane, W. A., Hemmingsen, Lars Bo Stegeager & Stachura, M., 26 Aug 2022, In: Angewandte Chemie International Edition. 61, 35, 8 p., e202207137.

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

  11. Published

    Extending NMR Quantum Computation Systems by Employing Compounds with Several Heavy Metals as Qubits

    Lino, J. B. D. R., Gonçalves, M. A., Sauer, Stephan P. A. & Ramalho, T. C., 21 Apr 2022, In: Magnetochemistry. 8, 5, 15 p., 47.

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

  12. Published

    A Tale of Two Vectors: A Lanczos Algorithm For Calculating RPA Mean Excitation Energies

    Zamok, L., Coriani, S. & Sauer, Stephan P. A., 3 Jan 2022, In: The Journal of Chemical Physics. 156, 1, 16 p., 014102.

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

Previous 1 2 3 4 5 6 7 8 ...26 Next

ID: 9770