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Chemical Communications (Cambridge, England)|November 3, 2023
Koopmans' theorem for acidic protonsTim Schrader, Jamoliddin Khanifaev, Eva PerltPhysical Chemistry Chemical Physics : PCCP|September 2, 2024
Machine-learning to predict anharmonic frequencies: a study of models and transferabilityJamoliddin Khanifaev, Tim Schrader, Eva PerltThe Journal of Chemical Physics|March 22, 2024
The effect of machine learning predicted anharmonic frequencies on thermodynamic properties of fluid hydrogen fluorideJamoliddin Khanifaev, Tim Schrader, Eva PerltThe Journal of Physical Chemistry. A|April 10, 2023
Performance of Common Density Functionals for Excited States of TetraphenyldibenzoperiflantheneTim Schrader, Eva Perlt, Torsten Fritz, et al.Physical Chemistry Chemical Physics : PCCP|October 25, 2017
The interaction of halogen atoms and molecules with boropheneJamoliddin Khanifaev, Rengin Peköz, Mine Konuk, et al.The Journal of Chemical Physics|April 8, 2017
Anharmonic effects in the quantum cluster equilibrium methodMichael von Domaros, Eva PerltPhysical Chemistry Chemical Physics : PCCP|March 7, 2014
Floating orbital molecular dynamics simulationsEva Perlt, Marc Brüssel, Barbara KirchnerMolecules (Basel, Switzerland)|February 25, 2022
The Ionic Product of Water in the Eye of the Quantum Cluster EquilibriumBarbara Kirchner, Johannes Ingenmey, Michael von Domaros, et al.Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|October 29, 2011
Importance of structural motifs in liquid hydrogen fluorideEva Perlt, Joachim Friedrich, Michael von Domaros, et al.Pageof 4