Wassja A Kopp (Wassja Kopp)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 11

Top Topics

Electron Transfer

Crystal Structure

Molecular Dynamics

Top Venues

Chemphyschem : a European journal of chemical physics and physical chemistry

The journal of physical chemistry. A

Physical chemistry chemical physics : PCCP

The Journal of chemical physics

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

Publications

Maximilian Fleck, Wassja A Kopp, Narasimhan Viswanathan, Niels Hansen, Joachim Groß, Kai Leonhard
Efficient Generation of Torsional Energy Profiles by Multifidelity Gaussian Processes for Hindered Rotor Corrections. Journal of chemical theory and computation (2024)
Taija L Fischer, Margarethe Bödecker, Sophie M Schweer, Jennifer Dupont, Valéria Lepère, Anne Zehnacker-Rentien, Martin A Suhm, Benjamin Schröder, Tobias Henkes, Diego M Andrada, Roman M Balabin, Haobam Kisan Singh, Himangshu Pratim Bhattacharyya, Manabendra Sarma, Silvan Käser, Kai Töpfer, Luis Itza Vazquez-Salazar, Eric D Boittier, Markus Meuwly, Giacomo Mandelli, Cecilia Lanzi, Riccardo Conte, Michele Ceotto, Fabian Dietrich, Vicente Cisternas, Ramachandran Gnanasekaran, Michael F A Hippler, Mahmoud Jarraya, Majdi Hochlaf, Narasimhan Viswanathan, Thomas Nevolianis, Gabriel Rath, Wassja A Kopp, Kai Leonhard, Ricardo A Mata
The first HyDRA challenge for computational vibrational spectroscopy. Physical chemistry chemical physics : PCCP 25 (33) (2023)
Wassja A Kopp, Can Huang, Yuqing Zhao, Peiyang Yu, Felix Schmalz, Lukas Krep, Kai Leonhard
Automatic Potential Energy Surface Exploration by Accelerated Reactive Molecular Dynamics Simulations: From Pyrolysis to Oxidation Chemistry. The journal of physical chemistry. A (2023)
Lukas Krep, Felix Schmalz, Florian Solbach, Leonid Komissarov, Thomas Nevolianis, Wassja A Kopp, Toon Verstraelen, Kai Leonhard
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes. Chemphyschem : a European journal of chemical physics and physical chemistry 24 (7) (2023)
Indu Sekhar Roy, K Alexander Heufer, Can Huang, Wassja A Kopp, Kai Leonhard
Influence of Oxygen Atoms and Ring Strain on the Low-Temperature Oxidation Pathways of 1,3-Dioxolane. The journal of physical chemistry. A (2023)
Wassja A Kopp, Matthias L Mödden, Narasimhan Viswanathan, Gabriel Rath, Kai Leonhard
Improved modeling of anharmonicity for furan microsolvation. Physical chemistry chemical physics : PCCP (2023)
Leonid Komissarov, Lukas Krep, Felix Schmalz, Wassja A Kopp, Kai Leonhard, Toon Verstraelen
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part I: Force Field Development. Chemphyschem : a European journal of chemical physics and physical chemistry (2022)
Lukas Krep, Felix Schmalz, Florian Solbach, Leonid Komissarov, Thomas Nevolianis, Wassja A Kopp, Toon Verstraelen, Kai Leonhard
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes. Chemphyschem : a European journal of chemical physics and physical chemistry (2022)
Justus Wöhl, Wassja A Kopp, Iryna Yevlakhovych, Leo Bahr, Hans-Jürgen Koß, Kai Leonhard
Completely Computational Model Setup for Spectroscopic Techniques: The Ab Initio Molecular Dynamics Indirect Hard Modeling Approach. The journal of physical chemistry. A 126 (18) (2022)
Hannes C Gottschalk, Anja Poblotzki, Mariyam Fatima, Daniel A Obenchain, Cristóbal Pérez, Jens Antony, Alexander A Auer, Leonardo Baptista, David M Benoit, Giovanni Bistoni, Fabian Bohle, Rahma Dahmani, Dzmitry Firaha, Stefan Grimme, Andreas Hansen, Michael E Harding, Majdi Hochlaf, Christof Holzer, Georg Jansen, Willem Klopper, Wassja A Kopp, Małgorzata Krasowska, Leif C Kröger, Kai Leonhard, Muneerah Mogren Al-Mogren, Halima Mouhib, Frank Neese, Max N Pereira, Muthuramalingam Prakash, Inga S Ulusoy, Ricardo A Mata, Martin A Suhm, Melanie Schnell
The first microsolvation step for furans: New experiments and benchmarking strategies. The Journal of chemical physics 152 (16) (2020)
Hannes C Gottschalk, Anja Poblotzki, Martin A Suhm, Muneerah M Al-Mogren, Jens Antony, Alexander A Auer, Leonardo Baptista, David M Benoit, Giovanni Bistoni, Fabian Bohle, Rahma Dahmani, Dzmitry Firaha, Stefan Grimme, Andreas Hansen, Michael E Harding, Majdi Hochlaf, Christof Holzer, Georg Jansen, Willem Klopper, Wassja A Kopp, Leif C Kröger, Kai Leonhard, Halima Mouhib, Frank Neese, Max N Pereira, Inga S Ulusoy, Axel Wuttke, Ricardo A Mata
The furan microsolvation blind challenge for quantum chemical methods: First steps. The Journal of chemical physics 148 (1) (2018)