Eva Perlt

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 13

Top Topics

Particulate Matter

Molecular Dynamics

Energy Transfer

Top Venues

The Journal of chemical physics

Physical chemistry chemical physics : PCCP

Angewandte Chemie (International ed. in English)

Scientific reports

This page only lists publications with an associated author ORCID identifier.

Publications

Jamoliddin Khanifaev, Tim Schrader, Eva Perlt
Machine-learning to predict anharmonic frequencies: a study of models and transferability. Physical chemistry chemical physics : PCCP (2024)
Mihail Barboiu, Barbara Kirchner, Eva Perlt, Alessandro Scarso
H 2 Open - Guest Editorial. ChemistryOpen (2023)
Tim Schrader, Eva Perlt, Torsten Fritz, Marek Sierka
Performance of Common Density Functionals for Excited States of Tetraphenyldibenzoperiflanthene. The journal of physical chemistry. A (2023)
Tim Schrader, Jamoliddin Khanifaev, Eva Perlt
Koopmans' theorem for acidic protons. Chemical communications (Cambridge, England) (2023)
Barbara Kirchner, Johannes Ingenmey, Michael von Domaros, Eva Perlt
The Ionic Product of Water in the Eye of the Quantum Cluster Equilibrium. Molecules (Basel, Switzerland) 27 (4) (2022)
Michael von Domaros, Yangdongling Liu, Jana L Butman, Eva Perlt, Franz M Geiger, Douglas J Tobias
Molecular Orientation at the Squalene/Air Interface from Sum Frequency Generation Spectroscopy and Atomistic Modeling. The journal of physical chemistry. B 125 (15) (2021)
Lucy E Darago, Monica D Boshart, Brian D Nguyen, Eva Perlt, Joseph W Ziller, Wayne W Lukens, Filipp Furche, William J Evans, Jeffrey R Long
Strong Ferromagnetic Exchange Coupling and Single-Molecule Magnetism in MoS43--Bridged Dilanthanide Complexes. Journal of the American Chemical Society 143 (22) (2021)
Jan Blasius, Johannes Ingenmey, Eva Perlt, Michael von Domaros, Oldamur Hollóczki, Barbara Kirchner
Predicting Mole-Fraction-Dependent Dissociation for Weak Acids. Angewandte Chemie (International ed. in English) 58 (10) (2019)
Eva Perlt, Sarah A Berger, Anne-Marie Kelterer, Barbara Kirchner
Anharmonicity of Vibrational Modes in Hydrogen Chloride-Water Mixtures. Journal of chemical theory and computation 15 (4) (2019)
Johannes Ingenmey, Michael von Domaros, Eva Perlt, Sergey P Verevkin, Barbara Kirchner
Thermodynamics and proton activities of protic ionic liquids with quantum cluster equilibrium theory. The Journal of chemical physics 148 (19) (2018)
Michael von Domaros, Eva Perlt
Anharmonic effects in the quantum cluster equilibrium method. The Journal of chemical physics 146 (12) (2018)
Eva Perlt, Promit Ray, Andreas Hansen, Friedrich Malberg, Stefan Grimme, Barbara Kirchner
Finding the best density functional approximation to describe interaction energies and structures of ionic liquids in molecular dynamics studies. The Journal of chemical physics 148 (19) (2018)
Eva Perlt, Michael von Domaros, Barbara Kirchner, Ralf Ludwig, Frank Weinhold
Predicting the Ionic Product of Water. Scientific reports 7 (1) (2017)