The complex-polarisation propagator formalism has been used to investigate both “traditional” and “perspective” new spectroscopies related to the absorption of light by the sample in presence of either external or internal magnetic fields. In particular, Magnetic Circular Dichroism, Magneto-Chiral Circular Dichroism and the Nuclear Spin Circular Dichroism spectra of various molecular systems will be discussed, highlighting in each specific case the information content that can be obtained by such spectroscopies [1-2]. References [1] Juha Vaara, Antonio Rizzo, Joanna Kauczor, Patrick Norman, and Sonia Coriani, J. Chem. Phys. 140, 134103 (2014); doi: 10.1063/1.4869849 [2] T. Kjærgaard, K. Kristensen, J. Kauczor, P. Jørgensen, S. Coriani, A. J. Thorvaldsen. J. Chem. Phys. 135 (2011), 024112 [3] Tobias Fahleson, Joanna Kauczor, Patrick Norman, and Sonia Coriani, Mol. Phys. 111 (2013) 1401-1404 [4] Fabrizio Santoro, Roberto Improta, Tobias Fahleson, Joanna Kauczor, Patrick Norman, and Sonia Coriani, J. Phys. Chem. Lett. 2014, in press [5] Janusz Cukras, Joanna Kauczor, Patrick Norman, Antonio Rizzo, Geert Rikken, and Sonia Coriani, in preparation.
Old and New Spectroscopies in “Strong” Magnetic Fields: MCD, MCHD, NSCD
CORIANI, Sonia
2014-01-01
Abstract
The complex-polarisation propagator formalism has been used to investigate both “traditional” and “perspective” new spectroscopies related to the absorption of light by the sample in presence of either external or internal magnetic fields. In particular, Magnetic Circular Dichroism, Magneto-Chiral Circular Dichroism and the Nuclear Spin Circular Dichroism spectra of various molecular systems will be discussed, highlighting in each specific case the information content that can be obtained by such spectroscopies [1-2]. References [1] Juha Vaara, Antonio Rizzo, Joanna Kauczor, Patrick Norman, and Sonia Coriani, J. Chem. Phys. 140, 134103 (2014); doi: 10.1063/1.4869849 [2] T. Kjærgaard, K. Kristensen, J. Kauczor, P. Jørgensen, S. Coriani, A. J. Thorvaldsen. J. Chem. Phys. 135 (2011), 024112 [3] Tobias Fahleson, Joanna Kauczor, Patrick Norman, and Sonia Coriani, Mol. Phys. 111 (2013) 1401-1404 [4] Fabrizio Santoro, Roberto Improta, Tobias Fahleson, Joanna Kauczor, Patrick Norman, and Sonia Coriani, J. Phys. Chem. Lett. 2014, in press [5] Janusz Cukras, Joanna Kauczor, Patrick Norman, Antonio Rizzo, Geert Rikken, and Sonia Coriani, in preparation.Pubblicazioni consigliate
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