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Profile
| Academic position | Post Doc |
|---|---|
| Research fields | Theoretical Chemistry: Electron Structure, Dynamics, Simulation |
| Keywords | Vibrational Coupled Cluster, Coordinate Recognition and Optimization, Quantum dynamics, reactions on aerosol surfaces, Curvilinear Coordinates |
Current contact address
| Country | Germany |
|---|---|
| City | Berlin |
| Institution | Freie Universität Berlin |
| Institute | Institut für Chemie und Biochemie |
Host during sponsorship
| Prof. Dr. Ove Christiansen | Department of Chemistry, Aarhus University, Aarhus |
|---|---|
| Start of initial sponsorship | 01/09/2023 |
Programme(s)
| 2023 | Feodor Lynen Research Fellowship Programme for Postdocs |
|---|
Publications (partial selection)
| 2024 | F. Bader, D. Lauvergnat, O. Christiansen: Efficient vibrationally correlated calculations using n-mode expansion-based kinetic energy operators. In: Physical Chemistry Chemical Physics, 26, 2024, |
|---|---|
| 2023 | F. Bader, D. Lauvergnat, O. Christiansen: Vibrationally correlated calculations in polyspherical coordinates: Taylor expansion-based kinetic energy operators. In: Journal of Chemical Physics, 159, 2023, |