Journal: Journal of Chemical Physics. BioChemical Physics
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Publisher
American Institute of Physics
13 results
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Publications 1 - 10 of 13
- Local relativistic exact decouplingItem type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsPeng, Daoling; Reiher, Markus (2012) - Construction of environment states in quantum-chemical density-matrix renormalization group calculationsItem type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsMoritz, Gerrit; Reiher, Markus (2006) - High-resolution millimeter wave spectroscopy and multichannel quantum defect theory of the hyperfine structure in high Rydberg states of molecular hydrogen H-2Item type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsOsterwalder, A.; Wüest, A.; Merkt, Frédéric; et al. (2004) - A fully relativistic method for calculation of nuclear magnetic shielding tensors with a restricted magnetically balanced basis in the framework of the matrix Dirac-Kohn-Sham equationItem type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsKomorovský, Stanislav; Repiský, Michal; Malkina, Olga L.; et al. (2008) - A new glance at HCI-monohydrate spectroscopy, using on-the-fly dynamicsItem type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsBuch, Victoria; Mohamed, Fawzi; Devlin, J. P.; et al. (2007) - Molecular structure calculationsItem type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsMatyus, Edit; Reiher, Markus (2012) - A cutoff phenomenon in accelerated stochastic simulations of chemical kinetics via flow averaging (FLAVOR-SSA)Item type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsBayati, Basil; Owhadi, Houman; Koumoutsakos, Petros (2010) - Deformation of inherent structures to detect long-range correlations in supercooled liquidsItem type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsMosayebi, Majid; Gado, Emanuela del; Ilg, Patrick; et al. (2012) - Second-order dipolar order in magic-angle spinning nuclear magnetic resonanceItem type: Journal Article
Journal of Chemical Physics. BioChemical Physicsvan Beek, Jacco D.; Hemmi, Adrian; Ernst, Matthias; et al. (2011) - CommunicationsItem type: Journal Article
Journal of Chemical Physics. BioChemical PhysicsBalabin, Roman M. (2010)
Publications 1 - 10 of 13