Kurt V. Mikkelsen

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Jacob KongstedUniverity of Southern DenmarkBekræftet mail på sdu.dk
Per-Olof ÅstrandNorwegian University of Science and TechnologyBekræftet mail på ntnu.no
hans agrenDepartment of Physics and Astronomy, Uppsala UniversityBekræftet mail på physics.uu.se
Jonas ElmAssist. Prof., Department of Chemistry, Aarhus UniversityBekræftet mail på chem.au.dk
Kenneth RuudHylleraas Centre for Quantum Molecular Sciences, University of Tromsø-The Arctic University ofBekræftet mail på uit.no
Peter R. OgilbyAarhus UniversityBekræftet mail på chem.au.dk
Mark A RatnerNorthwestern UniversityBekræftet mail på northwestern.edu
Trygve HelgakerUniversity of OsloBekræftet mail på kjemi.uio.no
Lasse JensenProfessor of Chemistry, Penn StateBekræftet mail på chem.psu.edu
Stine T OlsenPhD at Department of Chemistry, University of CopenhagenBekræftet mail på chem.ku.dk
Merete BildeAarhus UniversityBekræftet mail på chem.au.dk
Luo Yi - KTHProfessor of Theoretical Chemistry, Royal Institute of Technology, University of Science andBekræftet mail på kth.se
Hans Jørgen Aagaard JensenDepartment of Physics, Chemistry and Pharmacy; University of Southern DenmarkBekræftet mail på sdu.dk
Stephan P. A. SauerProfessor, Department of Chemistry, University of CopenhagenBekræftet mail på kiku.dk
Patrick NormanKTH Royal Institute of TechnologyBekræftet mail på kth.se
Anders B. SkovUniversity of CopenhagenBekræftet mail på chem.ku.dk
Fangqun YuResearch Associate and Professor, University at AlbanyBekræftet mail på albany.edu
Freja Eilsø StormPhD studerende, Kemi, Københavns UniversitetBekræftet mail på chem.ku.dk
Thomas Bondo PedersenHylleraas Centre for Quantum Molecular Sciences, Dept. of Chemistry, University of OsloBekræftet mail på kjemi.uio.no
Nicolai ReePhD Stud. @University of CopenhagenBekræftet mail på alumni.ku.dk

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Kurt V. Mikkelsen

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

Bekræftet 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	1118	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	653	1997
Electron tunneling in solid-state electron-transfer reactions KV Mikkelsen, MA Ratner Chemical Reviews 87 (1), 113-153, 1987	406	1987
DALTON, a molecular electronic structure program T Helgaker, HJA Jensen, P Jørgensen, J Olsen, K Ruud, H Ågren, ... Release 1, 63, 2001	333	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), 194114, 2009	268	2009
A multiconfigurational self‐consistent reaction‐field method KV Mikkelsen, H Ågren, HJA Jensen, T Helgaker The Journal of chemical physics 89 (5), 3086-3095, 1988	224	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	221	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	210	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	194	1994
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	162	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	154	2012
Electron-transfer reactions in solution: an ab initio approach KV Mikkelsen, E Dalgaard, P Swanstroem Journal of Physical Chemistry 91 (11), 3081-3092, 1987	149	1987
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), 154112, 2007	146	2007
Introduction to molecular dynamics and chemical kinetics GD Billing, KV Mikkelsen J. Wiley & Sons, 1996	142	1996
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	136	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	134	2002
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	132	2003
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	117	2005
Multiconfigurational self‐consistent reaction field theory for nonequilibrium solvation KV Mikkelsen, A Cesar, H Ågren, HJA Jensen The Journal of chemical physics 103 (20), 9010-9023, 1995	117	1995
Assessment of binding energies of atmospherically relevant clusters J Elm, M Bilde, KV Mikkelsen Physical Chemistry Chemical Physics 15 (39), 16442-16445, 2013	114	2013

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