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Research Group
Theoretical Chemistry

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University of Regensburg > Departments > Department of Chemistry & Pharmacy > Institute of Physical and Theoretical Chemistry > Research Group Theoretical Chemistry
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  1. D. Schemmel and M. Schütz, Molecular aniline clusters. II. The low-lying electronic excited states, J. Chem. Phys., 133, 134307 (2010).
  2. D. Schemmel and M. Schütz, Molecular aniline clusters. I. The electronic ground state, J. Chem. Phys., 132, 174303 (2010).
  3. D. Hoppe, D. Schemmel, M. Schütz, A. Pfitzner, Nb and Ta Adducts: Connecting d0 Metal Chlorides and Phosphorus Sulfide Cages, Chem. Eur. J., 15, 7129-7138 (2009).
  4. D. Schemmel and M. Schütz, The 2-Naphthol(water)2 cluster: Two competing types of hydrogen bonding arrangements, J. Chem. Phys., 129, 034301 (2008).
  5. D. Schemmel and M. Schütz, Phenol-Water 1..3 revisited: An ab-initio study on the photophysics of these clusters at the level of Coupled Cluster response theory, J. Chem. Phys., 127, 174304 (2007).
  6. D. Schemmel and M. Schütz, Phenol-water 1..3 revisited: An ab initio study on the photophysics of these clusters at the level of Coupled Cluster response theory, Vir. J. Bio. Phys. Res., 14, (2007).
 
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