Atoms and molecules in soft confinement potentials
Pašteka, L. F., Helgaker, T., Saue, T., Sundholm, D., Werner, H.-J., Hasanbulli, M., Major, J., Schwerdtfeger, P.
Published in Molecular physics (17.10.2020)
Published in Molecular physics (17.10.2020)
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Zero field splitting of the chalcogen diatomics using relativistic correlated wave-function methods
Rota, J-B, Knecht, S, Fleig, T, Ganyushin, D, Saue, T, Neese, F, Bolvin, H
Published in The Journal of chemical physics (21.09.2011)
Published in The Journal of chemical physics (21.09.2011)
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Four-Component Damped Density Functional Response Theory Study of UV/Vis Absorption Spectra and Phosphorescence Parameters of Group 12 Metal-Substituted Porphyrins
Fransson, Thomas, Saue, Trond, Norman, Patrick
Published in Journal of chemical theory and computation (10.05.2016)
Published in Journal of chemical theory and computation (10.05.2016)
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Linear complex polarization propagator in a four-component Kohn-Sham framework
Villaume, Sebastien, Saue, Trond, Norman, Patrick
Published in The Journal of chemical physics (14.08.2010)
Published in The Journal of chemical physics (14.08.2010)
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Beyond the electric-dipole approximation: A formulation and implementation of molecular response theory for the description of absorption of electromagnetic field radiation
List, Nanna Holmgaard, Kauczor, Joanna, Saue, Trond, Jensen, Hans Jørgen Aagaard, Norman, Patrick
Published in The Journal of chemical physics (28.06.2015)
Published in The Journal of chemical physics (28.06.2015)
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Quadratic response functions in the relativistic four-component Kohn-Sham approximation
Henriksson, Johan, Saue, Trond, Norman, Patrick
Published in The Journal of chemical physics (14.01.2008)
Published in The Journal of chemical physics (14.01.2008)
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Role of noncollinear magnetization for the first-order electric-dipole hyperpolarizability at the four-component Kohn-Sham density functional theory level
Bast, Radovan, Saue, Trond, Henriksson, Johan, Norman, Patrick
Published in The Journal of chemical physics (14.01.2009)
Published in The Journal of chemical physics (14.01.2009)
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Recent experimental and theoretical developments towards the observation of parity violation (PV) effects in molecules by spectroscopy
Crassous, Jeanne, Chardonnet, Christian, Saue, Trond, Schwerdtfeger, Peter
Published in Organic & biomolecular chemistry (21.06.2005)
Published in Organic & biomolecular chemistry (21.06.2005)
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