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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. S. Loibl and M. Schütz, Magnetizability and rotational g tensors for density fitted local second-order Møller-Plesset perturbation theory using gauge-including atomic orbitals, J. Chem. Phys., 141, 024108 (2014).
  2. S. Loibl and M. Schütz, NMR shielding tensors for density fitted local second-order Møller-Plesset perturbation theory using gauge including atomic orbitals, J. Chem. Phys., 137, 084107 (2012).
  3. S. Loibl, F. R. Manby, M. Schütz, Density fitted, local Hartree-Fock treatment of NMR chemical shifts using London atomic orbitals, Mol. Phys., 108, 477 (2010).
  4. D. Kats, D. Usvyat, S. Loibl, T. Merz, M. Schütz, Comment on "Minimax approximation for the decomposition of energy denominators in Laplace-transformed Møller-Plesset perturbation theories", J. Chem. Phys., 130, 127101 (2009).
 
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