Kurt Valentin Mikkelsen

Kurt Valentin Mikkelsen

Professor

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    ORCID: 0000-0003-4090-7697

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    1. Published

      Rovibrationally averaged magnetizability, rotational g factor, and indirect spin-spin coupling of the hydrogen fluoride molecule

      Åstrand, P. O., Ruud, K., Mikkelsen, Kurt Valentin & Helgaker, T., 1999, In: Journal of Chemical Physics. 110, p. 9463-9468

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

    2. Published

      Saturation of the third-order polarizability of carbon nanotubes characterized by a dipole interaction model

      Jensen, L., Åstrand, P. & Mikkelsen, Kurt Valentin, 2003, In: Nano Letters. 3 (5), p. 661-665

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

    3. Published

      Searching the Chemical Space of Bicyclic Dienes for Molecular Solar Thermal Energy Storage Candidates

      Hillers-Bendtsen, Andreas Erbs, Elholm, J. L., Obel, O. B., Hölzel, H., Moth-Poulsen, K. & Mikkelsen, Kurt Valentin, 2023, In: Angewandte Chemie - International Edition. 62, 40, 8 p., e202309543.

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

    4. Published

      Second harmonic generation second hyperpolarizability of water calculated using the combined coupled cluster dielectric continuum or different molecular mechanics methods

      Kongsted, J., Osted, A. I. & Mikkelsen, Kurt Valentin, 2004, In: Journal of Chemical Physics. 120, p. 3787-3798

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

    5. Published

      Self-trapping, bridge assistance, superexchange and intramolecular electron transfer: Some observations

      Todd, M. D., Mikkelsen, Kurt Valentin, Hupp, J. T. & Ratner, M. A., 1991, In: New Journal of Chemistry. 15, p. 97-105

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

    6. Published

      Semi-emprical studies of cobalamins, corrin models, and cobaloximes. The nucleotide loop does not strain the corrin ring in cobalamins

      Jensen, K. P. & Mikkelsen, Kurt Valentin, 2001, In: Inorganica Chimica Acta. 323, p. 5-15

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

    7. Published

      Shifts in Uracil: A Combined MD-QM/MM Study

      Olsen, J. M., Aidas, K., Mikkelsen, Kurt Valentin & Kongsted, J., 2010, In: Journal of Chemical Theory and Computation. 6, 1, p. 249-256

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

    8. Published

      Sign change of hyperpolarizabilities of solvated water, revised: Effects of equilibrium and nonequilibrium solvation

      Sylvester-Hvid, K. O., Mikkelsen, Kurt Valentin, Norman, P., Jonsson, D. & Ågren, H., 2004, In: Journal of Physical Chemistry A. 108, p. 8961-8965

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

    9. Published

      Simulating fullerene polyhedral formation from planar precursors

      Heuser, B., Mikkelsen, Kurt Valentin & Avery, James Emil, 21 Mar 2021, In: Physical Chemistry Chemical Physics. 23, 11, p. 6561-6573 13 p.

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

    10. Published

      Simulation framework for screening of molecular solar thermal systems in the context of a hybrid device

      Hansen, M. H., Olsen, S. T., Sylvester-Hvid, K. O. & Mikkelsen, Kurt Valentin, 2019, In: Chemical Physics. 519, p. 92-100

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

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