검색결과 : 13건
| No. | Article |
|---|---|
| 1 |
The vibrating hydroxide ion in water Hermansson K, Bopp PA, Spangberg D, Pejov L, Bako I, Mitev PD Chemical Physics Letters, 514(1-3), 1, 2011 |
| 2 |
Structure and Dynamics of Water Dangling OH Bonds in Hydrophobic Hydration Shells. Comparison of Simulation and Experiment Tomlinson-Phillips J, Davis J, Ben-Amotz D, Spangberg D, Pejov L, Hermansson K Journal of Physical Chemistry A, 115(23), 6177, 2011 |
| 3 |
On the Origins of Core-Electron Chemical Shifts of Small Biomolecules in Aqueous Solution: Insights from Photoemission and ab Initio Calculations of Glycine(aq) Ottosson N, Borve KJ, Spangberg D, Bergersen H, Saethre LJ, Faubel M, Pokapanich W, Ohrwall G, Bjorneholm E, Winter B Journal of the American Chemical Society, 133(9), 3120, 2011 |
| 4 |
Cations Strongly Reduce Electron-Hopping Rates in Aqueous Solutions Ottosson N, Odelius M, Spangberg D, Pokapanich W, Svanqvist M, Ohrwall G, Winter B, Bjorneholm O Journal of the American Chemical Society, 133(34), 13489, 2011 |
| 5 |
Molecular dynamics study of oxygen self-diffusion in reduced CeO2 Gotte A, Spangberg D, Hermansson K, Baudin M Solid State Ionics, 178(25-26), 1421, 2007 |
| 6 |
Using MD snapshots in ab initio and DFT calculations: OH vibrations in the first hydration shell around Li+(aq) Pejov L, Spangberg D, Hermansson K Journal of Physical Chemistry A, 109(23), 5144, 2005 |
| 7 |
Car-Parrinello molecular dynamics simulation of Fe3+(aq) Amira S, Spangberg D, Zelin V, Probst M, Hermansson K Journal of Physical Chemistry B, 109(29), 14235, 2005 |
| 8 |
Many-body potentials for aqueous Li+, Na+, Mg2+, and Al3+: Comparison of effective three-body potentials and polarizable models Spangberg D, Hermansson K Journal of Chemical Physics, 120(10), 4829, 2004 |
| 9 |
Molecular dynamics simulation of Fe2+(aq) and Fe3+(aq) Amira S, Spangberg D, Probst M, Hermansson K Journal of Physical Chemistry B, 108(1), 496, 2004 |
| 10 |
Effective three-body potentials for Li+(aq) and Mg2+(aq) Spangberg D, Hermansson K Journal of Chemical Physics, 119(14), 7263, 2003 |