Kurt Valentin Mikkelsen
Professor
ORCID: 0000-0003-4090-7697
1 - 5 out of 5Page size: 500
- 2009
- Published
Charge transfer excitation energies in pyridine-silver complexes studied by QM/MM methods
Arcisauskaité, V., Kongsted, J., Hansen, Thorsten & Mikkelsen, Kurt Valentin, 2009, In: Chemical Physics Letters. 470, p. 285Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Charge-resonance excitations in symmetric molecules - Comparison of linear response DFT with CC3 for the excited states of a model dimer
Kuhlman, T., Mikkelsen, Kurt Valentin, Møller, K. B. & Sølling, Theis Ivan, 2009, In: Chemical Physics Letters. 478, p. 127-131Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Molecular mechanics interaction models for optical electronic properties
Jensen, L., Åstrand, P. & Mikkelsen, Kurt Valentin, 2009, In: Journal of Computational and Theoretical Nanoscience. 6, p. 270-291Research output: Contribution to journal › Journal article › Research › peer-review
- Published
On the accurate calculation of polarizabilities and second hyperpolarizabilities of polyacetylene oligomer chains using the Coulomb-attenuating CAM-B3LYP density functional
Limacher, P., Mikkelsen, Kurt Valentin & Lüthi, H. P., 2009, In: Journal of Chemical Physics. 130, p. 194114Research output: Contribution to journal › Journal article › Research › peer-review
- Published
Prediction of Spin-Spin Coupling Constants in Solution based on Combined Density Functional Theory/Molecular Mechanics
Møgelhøj, A., Aidas, K., Mikkelsen, Kurt Valentin, Sauer, Stephan P. A. & Kongsted, J., 2009, In: Journal of Chemical Physics. 130, 13, p. 134508 12 p.Research output: Contribution to journal › Journal article › Research › peer-review
ID: 7494
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Direct probing of ion pair formation using a symmetric triangulenium dye
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293
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Dalton Project: A Python platform for molecular- and electronic-structure simulations of complex systems
Research output: Contribution to journal › Journal article › Research › peer-review
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265
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Single-molecule detection of dihydroazulene photo-thermal reaction using break junction technique
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Published