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ACS Omega
|
February 18, 2020
Correcting Rate Constants from Anharmonic Molecular Dynamics for Quantum Effects
Felix Schmalz, Wassja A Kopp, Leif C Kröger, et al.
Journal of Chemical Information and Modeling
|
June 14, 2018
Automated Chemical Kinetic Modeling via Hybrid Reactive Molecular Dynamics and Quantum Chemistry Simulations
Malte Döntgen, Felix Schmalz, Wassja A Kopp, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
December 30, 2022
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part I: Force Field Development
Leonid Komissarov, Lukas Krep, Felix Schmalz, et al.
Journal of Chemical Information and Modeling
|
February 10, 2022
Efficient Reaction Space Exploration with ChemTraYzer-TAD
Lukas Krep, Indu Sekhar Roy, Wassja Kopp, et al.
The Journal of Physical Chemistry. A
|
December 7, 2023
Automatic Potential Energy Surface Exploration by Accelerated Reactive Molecular Dynamics Simulations: From Pyrolysis to Oxidation Chemistry
Wassja A Kopp, Can Huang, Yuqing Zhao, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
December 13, 2022
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes
Lukas Krep, Felix Schmalz, Florian Solbach, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
April 3, 2023
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes
Lukas Krep, Felix Schmalz, Florian Solbach, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
ACS Omega
|
February 18, 2020
Correcting Rate Constants from Anharmonic Molecular Dynamics for Quantum Effects
Felix Schmalz, Wassja A Kopp, Leif C Kröger, et al.
Journal of Chemical Information and Modeling
|
June 14, 2018
Automated Chemical Kinetic Modeling via Hybrid Reactive Molecular Dynamics and Quantum Chemistry Simulations
Malte Döntgen, Felix Schmalz, Wassja A Kopp, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
December 30, 2022
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part I: Force Field Development
Leonid Komissarov, Lukas Krep, Felix Schmalz, et al.
Journal of Chemical Information and Modeling
|
February 10, 2022
Efficient Reaction Space Exploration with ChemTraYzer-TAD
Lukas Krep, Indu Sekhar Roy, Wassja Kopp, et al.
The Journal of Physical Chemistry. A
|
December 7, 2023
Automatic Potential Energy Surface Exploration by Accelerated Reactive Molecular Dynamics Simulations: From Pyrolysis to Oxidation Chemistry
Wassja A Kopp, Can Huang, Yuqing Zhao, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
December 13, 2022
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes
Lukas Krep, Felix Schmalz, Florian Solbach, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
April 3, 2023
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes
Lukas Krep, Felix Schmalz, Florian Solbach, et al.
Page
of 1