Stephan P. A. Sauer

Stephan P. A. Sauer

Professor


  1. Published

    A second-order doubles correction to excitation energies in the random-phase approximation

    Christiansen, O., Bak, K. L., Koch, H. & Sauer, Stephan P. A., 1998, In: Chemical Physics Letters. 284, 1-2, p. 47-55 9 p.

    Research output: Contribution to journalJournal articleResearchpeer-review

  2. A sum-over-states formulation of the diamagnetic contribution to the indirect nuclear spin-spin coupling constant

    Sauer, Stephan P. A., 1993, In: Journal of Chemical Physics. 98, 11, p. 9220-9221

    Research output: Contribution to journalJournal articleResearchpeer-review

  3. 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 journalJournal articleResearchpeer-review

  4. Published

    Ab Initio Calculation of the Electronic Spectrum of Azobenzene Dyes and Its Impact on the Design of Optical Data Storage Materials

    Åstrand, P., Ramanujam, P. S., Hvilsted, S., Bak, K. L. & Sauer, Stephan P. A., 2000, In: Journal of the American Chemical Society. 122, 14, p. 3482-3487

    Research output: Contribution to journalJournal articleResearchpeer-review

  5. Published

    Ab initio calculations on 2-imidazolyl-2-thiazolyl azo compounds - an investigation of potential near-infrared absorbing structures

    Åstrand, P., Bak, K. L. & Sauer, Stephan P. A., 2001, In: Chemical Physics Letters. 343, 1-2, p. 171-177

    Research output: Contribution to journalJournal articleResearchpeer-review

  6. 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 journalJournal articleResearchpeer-review

  7. Published

    Amino acid mean excitation energies and directional dependencies from core and bond calculations

    Sabin, J. R., Oddershede, J. & Sauer, Stephan P. A., 2008, In: A I P Conference Proceedings. 1080, p. 138-144 7 p.

    Research output: Contribution to journalConference articleResearchpeer-review

  8. Published

    An Isofagomine Analogue with an Amidine at the Pseudoanomeric Position

    Lindbäck, E., López, Ó., Fernández-Bolaños, J. G., Sauer, Stephan P. A. & Bols, Mikael, 6 May 2011, In: Organic Letters. 13, 11, p. 2908-2911

    Research output: Contribution to journalJournal articleResearchpeer-review

  9. Published

    Analysis of Isotope Effects in NMR One-bond Indirect Nuclear Spin-spin Coupling Constants in Terms of Localized Molecular Orbitals

    Provasi, P. F. & Sauer, Stephan P. A., 2009, In: Physical Chemistry Chemical Physics. 11, p. 3987-3995

    Research output: Contribution to journalJournal articleResearchpeer-review

  10. Published

    Analysis of pure rotational and vibration-rotational spectra of NaCl X 1S+ and quantum-chemical calculation of related molecular properties

    Ogilvie, J. F., Jensen, H. J. A. & Sauer, Stephan P. A., 2005, In: Journal of the Chinese Chemical Society. 52, 4, p. 631-639

    Research output: Contribution to journalJournal articleResearchpeer-review

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ID: 9770