Publications by authors named "Markus Thut"

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Time-dependent density functional theory as a tool for isomer assignments of hydrogen-bonded solute.solvent clusters.
Markus Thut, Christian Tanner, Andreas Steinlin, Samuel Leutwyler

J Phys Chem A· June 2008

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Theory of High-Spin d(4) Complexes: An Angular-Overlap Model Parametrization of the Ligand Field in Vibronic-Coupling Calculations.
Graham Carver, Markus Thut, Christopher Noble, Philip L W Tregenna-Piggott

J Chem Theory Comput· April 2008

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Spectral tuning by switching C-H[...]O hydrogen bonds: rotation-induced spectral shifts of 7-hydroxyquinoline HCOOH isomers.
Markus Thut, Carine Manca, Christian Tanner, Samuel Leutwyler

J Chem Phys· January 2008

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Excited-state hydrogen-atom transfer along solvent wires: water molecules stop the transfer.
Christian Tanner, Markus Thut, Andreas Steinlin, Carine Manca, Samuel Leutwyler

J Phys Chem A· February 2006

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