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Profile
| Academic position | Post Doc |
|---|---|
| Research fields | Theoretical Chemistry: Electron Structure, Dynamics, Simulation,Inorganic Molecular Chemistry |
| Keywords | theoretical chemistry, bioinorganic chemistry, EPR, molecular magnetism, spin couplin |
Current contact address
Host during sponsorship
| Prof. Dr. Martin Kaupp | Institut für Anorganische Chemie, Julius-Maximilians-Universität Würzburg, Würzburg |
|---|---|
| Prof. Dr. Martin Kaupp | Institut für Chemie, Technische Universität Berlin, Berlin |
| Start of initial sponsorship | 01/03/2010 |
Programme(s)
| 2009 | Humboldt Research Fellowship Programme for Postdocs |
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Publications (partial selection)
| 2011 | D. Mitra, V. Pelmenschikov, Y. Guo, D. A. Case, H. Wang, W. Dong, M.-L. Tan, T. Ichiye, F. E. Jenney, M. W. W. Adams, Y. Yoda, J. Zhao, S. P. Cramer: Dynamics of the [4Fe-4S] Cluster in Pyrococcus furiosus D14C Ferredoxin via Nuclear Resonance Vibrational and Resonance Raman Spectroscopies, Force Field Simulations, and Density Functional Theory Calculations . In: Biochemistry, 2011, 5220-5235 |
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| 2011 | V. Pelmenschikov, Y. Guo, H. Wang, S. P. Cramer, D. A. Case: Fe-H/D stretching and bending modes in nuclear resonance vibrational, Raman and infrared spectroscopies: Comparisons of density functional theory and experiment. In: Faraday Discuss., 2011, 409-420 |