Kurt V. Mikkelsen

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Jacob KongstedUniverity of Southern DenmarkVerificeret mail på sdu.dk
Ove ChristiansenDepartment of Chemistry, Aarhus UniversityVerificeret mail på chem.au.dk
Per-Olof ÅstrandNTNU - Norwegian University of Science and TechnologyVerificeret mail på ntnu.no
hans agrenDepartment of Physics and Astronomy, Uppsala UniversityVerificeret mail på physics.uu.se
Jonas ElmAssist. Prof., Department of Chemistry, Aarhus UniversityVerificeret mail på chem.au.dk
Peter R. OgilbyAarhus UniversityVerificeret mail på chem.au.dk
Kenneth RuudHylleraas Centre for Quantum Molecular Sciences, University of Tromsø-The Arctic University ofVerificeret mail på uit.no
Andreas Erbs Hillers-BendtsenStanford UniversityVerificeret mail på stanford.edu
Mark A RatnerNorthwestern UniversityVerificeret mail på northwestern.edu
Trygve HelgakerUniversity of OsloVerificeret mail på kjemi.uio.no
Lasse JensenProfessor of Chemistry, Penn StateVerificeret mail på chem.psu.edu
Stine T OlsenPhD at Department of Chemistry, University of CopenhagenVerificeret mail på chem.ku.dk
Merete BildeAarhus UniversityVerificeret mail på chem.au.dk
Stephan P. A. SauerProfessor, Department of Chemistry, University of CopenhagenVerificeret mail på kiku.dk
Hans Jørgen Aagaard JensenDepartment of Physics, Chemistry and Pharmacy; University of Southern DenmarkVerificeret mail på sdu.dk
Luo Yi - KTHProfessor of Theoretical Chemistry, Royal Institute of Technology, University of Science andVerificeret mail på kth.se
Patrick NormanKTH Royal Institute of TechnologyVerificeret mail på kth.se
Freja Eilsø StormPhD studerende, Kemi, Københavns UniversitetVerificeret mail på chem.ku.dk
Nicolai ReePostdoc @University of Copenhagen in colab with Bayer AGVerificeret mail på alumni.ku.dk
Anders B. SkovUniversity of Copenhagen, Koppers Performance ChemicalsVerificeret mail på chem.ku.dk

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Kurt V. Mikkelsen

Professor of Theoretical Chemistry, Department of Chemistry, University of Copenhagen

Verificeret mail på chem.ku.dk

Theoretical chemistry


Titel Sortér efter henvisninger Sortér efter årstal Sortér efter titel	Citeret af Citeret af	År
The D alton quantum chemistry program system K Aidas, C Angeli, KL Bak, V Bakken, R Bast, L Boman, O Christiansen, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (3), 269-284, 2014	1472	2014
Investigation of the temperature dependence of dielectric relaxation in liquid water by THz reflection spectroscopy and molecular dynamics simulation C Ro/nne, L Thrane, PO Åstrand, A Wallqvist, KV Mikkelsen, SR Keiding The Journal of chemical physics 107 (14), 5319-5331, 1997	735	1997
Electron tunneling in solid-state electron-transfer reactions KV Mikkelsen, MA Ratner Chemical Reviews 87 (1), 113-153, 1987	414	1987
DALTON, a molecular electronic structure program T Helgaker, HJA Jensen, P Jørgensen, J Olsen, K Ruud, H Ågren, ... Release 1, 63, 2001	351	2001
On the accurate calculation of polarizabilities and second hyperpolarizabilities of polyacetylene oligomer chains using the CAM-B3LYP density functional PA Limacher, KV Mikkelsen, HP Lüthi The Journal of chemical physics 130 (19), 2009	302	2009
A multiconfigurational self‐consistent reaction‐field method KV Mikkelsen, H Ågren, HJ Jensen, T Helgaker The Journal of chemical physics 89 (5), 3086-3095, 1988	248	1988
Polarizability of molecular clusters as calculated by a dipole interaction model L Jensen, PO Åstrand, A Osted, J Kongsted, KV Mikkelsen The Journal of chemical physics 116 (10), 4001-4010, 2002	246	2002
Two-photon photosensitized production of singlet oxygen in water PK Frederiksen, SP McIlroy, CB Nielsen, L Nikolajsen, E Skovsen, ... Journal of the American Chemical Society 127 (1), 255-269, 2005	224	2005
Solvent induced polarizabilities and hyperpolarizabilities of para‐nitroaniline studied by reaction field linear response theory KV Mikkelsen, Y Luo, H Ågren, P Jo/rgensen The Journal of chemical physics 100 (11), 8240-8250, 1994	199	1994
Assessment of density functional theory in predicting structures and free energies of reaction of atmospheric prenucleation clusters J Elm, M Bilde, KV Mikkelsen Journal of chemical theory and computation 8 (6), 2071-2077, 2012	195	2012
A multiconfiguration self‐consistent reaction field response method KV Mikkelsen, P Jo/rgensen, HJA Jensen The Journal of chemical physics 100 (9), 6597-6607, 1994	167	1994
Density functional self-consistent quantum mechanics/molecular mechanics theory for linear and nonlinear molecular properties: Applications to solvated water and formaldehyde CB Nielsen, O Christiansen, KV Mikkelsen, J Kongsted The Journal of chemical physics 126 (15), 2007	161	2007
Two-photon photosensitized production of singlet oxygen: sensitizers with phenylene− ethynylene-based chromophores SP McIlroy, E Cló, L Nikolajsen, PK Frederiksen, CB Nielsen, ... The Journal of organic chemistry 70 (4), 1134-1146, 2005	149	2005
The QM/MM approach for wavefunctions, energies and response functions within self-consistent field and coupled cluster theories J Kongsted, A Osted, KV Mikkelsen, O Christiansen Molecular Physics 100 (11), 1813-1828, 2002	146	2002
Electron-transfer reactions in solution: an ab initio approach KV Mikkelsen, E Dalgaard, P Swanstroem Journal of Physical Chemistry 91 (11), 3081-3092, 1987	146	1987
Assessment of binding energies of atmospherically relevant clusters J Elm, M Bilde, KV Mikkelsen Physical Chemistry Chemical Physics 15 (39), 16442-16445, 2013	145	2013
Linear response functions for coupled cluster/molecular mechanics including polarization interactions J Kongsted, A Osted, KV Mikkelsen, O Christiansen The Journal of chemical physics 118 (4), 1620-1633, 2003	144	2003
Introduction to molecular dynamics and chemical kinetics GD Billing, KV Mikkelsen, DG Truhlar Physics Today 49 (10), 74-76, 1996	144	1996
Coupled cluster calculation of the n→ π* electronic transition of acetone in aqueous solution K Aidas, J Kongsted, A Osted, KV Mikkelsen, O Christiansen The Journal of Physical Chemistry A 109 (35), 8001-8010, 2005	124	2005
Single-molecule detection of dihydroazulene photo-thermal reaction using break junction technique C Huang, M Jevric, A Borges, ST Olsen, JM Hamill, JT Zheng, Y Yang, ... Nature communications 8 (1), 15436, 2017	123	2017

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