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Chemsuschem|September 24, 2017
Discovery of Open Cubane Core Structures for Biomimetic LnCo3 (OR)4 Water Oxidation CatalystsMauro Schilling, Florian H Hodel, Sandra LuberChemistry (Weinheim an Der Bergstrasse, Germany)|November 13, 2009
Understanding the signatures of secondary-structure elements in proteins with Raman optical activity spectroscopyChristoph R Jacob, Sandra Luber, Markus ReiherJournal of Chemical Theory and Computation|May 1, 2023
Magnetic Interactions in a [Co(II)3Er(III)(OR)4] Model Cubane through Forefront Multiconfigurational MethodsRuocheng Han, Sandra Luber, Giovanni Li ManniJournal of Chemical Theory and Computation|January 4, 2021
A Machine Learning Approach for MP2 Correlation Energies and Its Application to Organic CompoundsRuocheng Han, Mauricio Rodríguez-Mayorga, Sandra LuberThe Journal of Physical Chemistry. B|April 14, 2009
Analysis of secondary structure effects on the IR and Raman spectra of polypeptides in terms of localized vibrationsChristoph R Jacob, Sandra Luber, Markus ReiherJournal of Chemical Theory and Computation|June 14, 2017
Exploring Solvation Effects in Ligand-Exchange Reactions via Static and Dynamic MethodsFlorian H Hodel, Peter Deglmann, Sandra LuberNpj Computational Materials|December 23, 2024
Predicting electronic screening for fast Koopmans spectral functional calculationsYannick Schubert, Sandra Luber, Nicola Marzari, et al.Journal of Chemical Theory and Computation|April 1, 2022
Implementation of Nuclear Velocity Perturbation and Magnetic Field Perturbation Theory in CP2K and Their Application to Vibrational Circular DichroismEdward Ditler, Tomáš Zimmermann, Chandan Kumar, et al.Angewandte Chemie (International Ed. in English)|August 25, 2016
Symmetry Breaking in Chiral Ionic Liquids Evidenced by Vibrational Optical ActivityPatric Oulevey, Sandra Luber, Birte Varnholt, et al.Chimia|December 4, 2023
Enabling Direct Photoelectrochemical H₂ Production using Alternative Oxidation Reactions on WO₃Nukorn Plainpan, Rangsiman Ketkaew, Sandra Luber, et al.Pageof 253