Kurt Valentin Mikkelsen

Kurt Valentin Mikkelsen

Professor

Member of:

    ORCID: 0000-0003-4090-7697

    Publication year:
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    1 - 10 out of 12Page size: 10
    1. 2007
    2. Published

      Density functional self-consistent quantum mechanics/molecular mechanics theory for linear and nonlinear molecular properties: Applications to solvated water and formaldehyde

      Nielsen, C. B., Christiansen, O., Mikkelsen, Kurt Valentin & Kongsted, J., 2007, In: Journal of Chemical Physics. 126, 15, p. 154112

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

    3. Published

      Gauge-origin independent magnetizabilities from hybrid quantum mechanics/molecular mechanics models: Theory and applications to liquid water

      Aidas, K., Kongsted, J., Nielsen, C. B., Mikkelsen, Kurt Valentin, Christiansen, O. & Ruud, K., 2007, In: Chemical Physics Letters. 442, 4-6, p. 322-328

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

    4. Published

      Homogeneous Solvent Models for Linear and Nonlinear Optical Properties

      Mikkelsen, Kurt Valentin, 2007, In: Computing Letters. 3, p. 315-331

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

    5. Published

      Homogeneous and Heterogeneous Solvent Models for Nonlinear Optical Properties

      Mikkelsen, Kurt Valentin & Ågren, H., 2007, Continuum Solvation Models in Chemical Physics. Mennucci, B. & Cammi, R. (eds.). Chichester: Wiley, p. 282-299

      Research output: Chapter in Book/Report/Conference proceeding › Book chapter › Research

    6. Published

      Hybrid Methods for Molecular Properties

      Mikkelsen, Kurt Valentin, 2007, Continuum Solvation Models in Chemical Physics. Mennucci, B. & Cammi, R. (eds.). Chichester: Wiley, p. 538-557

      Research output: Chapter in Book/Report/Conference proceeding › Book chapter › Research

    7. Published

      Hydrogen bonding effects on infrared and Raman spectra of drug molecules

      Bondesson, L., Mikkelsen, Kurt Valentin, Luo, Y., Garberg, P. & Ågren, H., 2007, In: Spectrochimica Acta, Part A. 66, 2, p. 213-224

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

    8. Published

      Modelling Spectroscropic Properties of Large Molecular Systems. The Combined Density Functional Theory/Molecular Mechanics Approach

      Aidas, K., Mikkelsen, Kurt Valentin & Kongsted, J., 2007, In: Journal of Computational Methods in Sciences and Engineering. 7, p. 135-158

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

    9. Published

      Nuclear magnetic shielding constants of liquid water: Insights from hybrid quantum mechanics/molecular mechanics models

      Kongsted, J., Nielsen, C. B., Mikkelsen, Kurt Valentin, Christiansen, O. & Ruud, K., 2007, In: Journal of Chemical Physics. 126, 3, p. 034510

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

    10. Published

      Quantum Nature of the Sign Preference in Ion-Induced Nucleation. Reply to Comment

      Nadykto, A., Natshed, A. A., Mikkelsen, Kurt Valentin, Yu, F. & Ruuskanen, J., 2007, In: Physical Review Letters. 98, 10, p. 109604 1 p.

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

    11. Published

      Solvent effects on NMR isotropic shielding constants. A comparison between explicit polarizable discrete and continuum approaches

      Aidas, K., Møgelhøj, A., Kjær, H., Nielsen, C. B., Mikkelsen, Kurt Valentin, Ruud, K., Christiansen, O. & Kongsted, J., 2007, In: Journal of Physical Chemistry A. 111, 20, p. 4199-4210

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

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