Artikler med krav om offentlig adgang - Kurt V. MikkelsenFå flere oplysninger
Ikke tilgængelige nogen steder: 41
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
Krav: Swiss National Science Foundation
Hydration of atmospheric molecular clusters: a new method for systematic configurational sampling
JV Kildgaard, KV Mikkelsen, M Bilde, J Elm
The Journal of Physical Chemistry A 122 (22), 5026-5036, 2018
Krav: Villum Founden
Computational methodology study of the optical and thermochemical properties of a molecular photoswitch
ST Olsen, J Elm, FE Storm, AN Gejl, AS Hansen, MH Hansen, ...
The Journal of Physical Chemistry A 119 (5), 896-904, 2015
Krav: Frie Forskningsråd
Computational study of the effect of glyoxal–sulfate clustering on the Henry’s law coefficient of glyoxal
T Kurten, J Elm, NL Prisle, KV Mikkelsen, CJ Kampf, EM Waxman, ...
The Journal of Physical Chemistry A 119 (19), 4509-4514, 2015
Krav: US Department of Energy, German Research Foundation, Frie Forskningsråd …
Controlling Two‐Step Multimode Switching of Dihydroazulene Photoswitches
AU Petersen, SL Broman, ST Olsen, AS Hansen, L Du, A Kadziola, ...
Chemistry–A European Journal 21 (10), 3968-3977, 2015
Krav: Frie Forskningsråd, Swedish Research Council
Prospects of improving molecular solar energy storage of the norbornadiene/Quadricyclane system through bridgehead modifications
AE Hillers-Bendtsen, PG Iuel Lunøe Dünweber, LH Olsen, KV Mikkelsen
The Journal of Physical Chemistry A 126 (17), 2670-2676, 2022
Krav: European Commission
Luminescence Spectroscopy of Rhodamine Homodimer Dications in Vacuo Reveals Strong Dye‐Dye Interactions
C Kjaer, H Lissau, NK Gravesen Salinas, A Østergaard Madsen, ...
ChemPhysChem 20 (4), 533-537, 2019
Krav: Swedish Research Council
Obtaining enhanced circular dichroism in [4] heterohelicenium analogues
J Elm, J Lykkebo, TJ Sørensen, BW Laursen, KV Mikkelsen
The Journal of Physical Chemistry A 116 (34), 8744-8752, 2012
Krav: Frie Forskningsråd, Danmarks Grundforskningsfond
Investigation of the Structural and Thermochemical Properties of [2.2. 2]-Bicyclooctadiene Photoswitches
AE Hillers-Bendtsen, M Quant, K Moth-Poulsen, KV Mikkelsen
The Journal of Physical Chemistry A 125 (48), 10330-10339, 2021
Krav: Swedish Research Council for Environment, Agricultural Sciences and Spatial …
Elucidation of the intrinsic optical properties of hydrogen-bonded and protonated flavin chromophores by photodissociation action spectroscopy
K Lincke, J Langeland, AØ Madsen, HV Kiefer, L Skov, E Gruber, ...
Physical Chemistry Chemical Physics 20 (45), 28678-28684, 2018
Krav: Villum Founden
Cluster perturbation theory. VI. Ground-state energy series using the Lagrangian
NM Høyer, FØ Kjeldal, AE Hillers-Bendtsen, KV Mikkelsen, J Olsen, ...
The Journal of Chemical Physics 157 (2), 2022
Krav: Frie Forskningsråd, European Commission
The effects of solvation on the back reaction and storage capabilities of solar thermal energy storage systems
ILH Kjeldsen, JF Høvring, TJ von Buchwald, AE Hillers-Bendtsen, ...
Physical Chemistry Chemical Physics 24 (9), 5564-5577, 2022
Krav: Frie Forskningsråd, European Commission
Molecular properties of sandwiched molecules between electrodes and nanoparticles
ST Olsen, A Bols, T Hansen, KV Mikkelsen
Advances in Quantum Chemistry 75, 53-102, 2017
Krav: Frie Forskningsråd
Cluster perturbation theory. VIII. First order properties for a coupled cluster state
AE Hillers-Bendtsen, NM Høyer, FØ Kjeldal, KV Mikkelsen, J Olsen, ...
The Journal of Chemical Physics 157 (2), 2022
Krav: Frie Forskningsråd, European Commission
Cluster perturbation theory. VII. The convergence of cluster perturbation expansions
J Olsen, AE Hillers-Bendtsen, FØ Kjeldal, NM Høyer, KV Mikkelsen, ...
The Journal of Chemical Physics 157 (2), 2022
Krav: Frie Forskningsråd, European Commission
A neural network approach for property determination of molecular solar cell candidates
O Christensen, RD Schlosser, RB Nielsen, J Johansen, M Koerstz, ...
The Journal of Physical Chemistry A 126 (10), 1681-1688, 2022
Krav: Frie Forskningsråd, European Commission
Benchmarking sampling methodology for calculations of Rayleigh light scattering properties of atmospheric molecular clusters
T Joranger, JV Kildgaard, S Jørgensen, J Elm, KV Mikkelsen
Physical Chemistry Chemical Physics 21 (31), 17274-17287, 2019
Krav: Swedish Research Council for Environment, Agricultural Sciences and Spatial …
Redfield propagation of photoinduced electron transfer reactions in vacuum and solution
J Pedersen, MH Rasmussen, KV Mikkelsen
Journal of Chemical Theory and Computation 18 (12), 7052-7072, 2022
Krav: Frie Forskningsråd, European Commission
Promoting the thermal back reaction of vinylheptafulvene to dihydroazulene by physisorbtion on nanoparticles
AE Hillers-Bendtsen, MB Johansen, KV Mikkelsen
Physical Chemistry Chemical Physics 23 (22), 12889-12899, 2021
Krav: European Commission
Characterisation of dihydroazulene and vinylheptafulvene derivatives using Raman spectroscopy: The CN-stretching region
AS Hansen, K Mackeprang, SL Broman, MH Hansen, AS Gertsen, ...
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 161, 70-76, 2016
Krav: Frie Forskningsråd
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