검색결과 : 109건
| No. | Article |
|---|---|
| 1 |
Hydration of Atmospheric Molecular Clusters III: Procedure for Efficient Free Energy Surface Exploration of Large Hydrated Clusters Rasmussen FR, Kubecka J, Besel V, Vehkamaki H, Mikkelsen KV, Bilde M, Elm J Journal of Physical Chemistry A, 124(25), 5253, 2020 |
| 2 |
Electronic Predissociation in the Dichloromethane Cation CH2Cl2+ Electronic State (2)A(1) Petersen AC, Koerstz M, Mikkelsen KV, Solling TI Journal of Physical Chemistry A, 123(18), 4048, 2019 |
| 3 |
Hydration of Atmospheric Molecular Clusters: A New Method for Systematic Configurational Sampling Kildgaard JV, Mikkelsen KV, Bilde M, Elm J Journal of Physical Chemistry A, 122(22), 5026, 2018 |
| 4 |
Hydration of Atmospheric Molecular Clusters II: Organic Acid-Water Clusters Kildgaard JV, Mikkelsen KV, Bilde M, Elm J Journal of Physical Chemistry A, 122(43), 8549, 2018 |
| 5 |
Density Functional Theory Investigation on Boron Subphthalocyanine-Ferrocene Dyads Rasmussen MH, Vishart AL, Storm FE, Mikkelsen KV Journal of Physical Chemistry A, 122(38), 7620, 2018 |
| 6 |
Benchmark Study of the Structural and Thermochemical Properties of a Dihydroazulene/Vinylheptafulvene Photoswitch Koerstz M, Elm J, Mikkelsen KV Journal of Physical Chemistry A, 121(16), 3148, 2017 |
| 7 |
Density Functional Theory Study of the Solvent Effects on Systematically Substituted Dihydroazulene/Vinylheptafulvene Systems: Improving the Capability of Molecular Energy Storage Ree N, Hansen MH, Gertsen AS, Mikkelsen KV Journal of Physical Chemistry A, 121(46), 8856, 2017 |
| 8 |
Boron Subphthalocyanine Based Molecular Triad Systems for the Capture of Solar Energy Storm FE, Olsen ST, Hansen T, De Vico L, Jackson NE, Ratner MA, Mikkelsen KV Journal of Physical Chemistry A, 120(39), 7694, 2016 |
| 9 |
Theoretical Investigation of Substituent Effects on the Dihydroazulene/Vinylheptafulvene Photoswitch: Increasing the Energy Storage Capacity Hansen MH, Elm J, Olsen ST, Gejl AN, Storm FE, Frandsen BN, Skov AB, Nielsen MB, Kjaergaard HG, Mikkelsen KV Journal of Physical Chemistry A, 120(49), 9782, 2016 |
| 10 |
Computational Methodology Study of the Optical and Thermochemical Properties of a Molecular Photoswitch Olsen ST, Elm J, Storm FE, Gejl AN, Hansen AS, Hansen MH, Nikolajsen JR, Nielsen MB, Kjaergaard HG, Mikkelsen KV Journal of Physical Chemistry A, 119(5), 896, 2015 |