Behler, Jörg

1. Ab initio thermodynamics of liquid and solid water
   2018/11/21 by Cheng, Bingqing, Engel, Edgar A., Behler, Jörg +2 · 14 citations
   #Chemical Physics (physics.chem-ph) #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci) #Statistical Mechanics (cond-mat.stat-mech)
2. Neural Network Potentials: A Concise Overview of Methods
   2021/07/08 by Emir Kocer, Kocer, Emir, Tsz Wai Ko +3 · 16 citations
   Materials Science · Computer Science · Chemistry · #Machine Learning in Materials Science #Computational Drug Discovery Methods #Electrochemical Analysis and Applications
3. Roadmap on Advancements of the FHI-aims Software Package
   2025/04/30 by Joseph W. Abbott, Abbott, Joseph W., Carlos Mera Acosta +405 · 3 voices · 9 citations
   #cond-mat.mtrl-sci #physics.chem-ph
4. Global Optimization of Copper Clusters at the ZnO(10-10) Surface Using a DFT-based Neural Network Potential and Genetic Algorithms
   2020/07/13 by Paleico, Martín Leandro, Behler, Jörg · 2 citations
   #Chemical Physics (physics.chem-ph) #Computational Physics (physics.comp-ph) #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci)
5. Machine Learning Potentials for Heterogeneous Catalysis
   2024/11/01 by Amir Omranpour, Jan Elsner, Omranpour, Amir +5 · 6 citations
   Materials Science · #Machine Learning in Materials Science
6. Machine learning potentials for redox chemistry in solution
   2024/10/04 by Emir Kocer, Redouan El Haouari, Kocer, Emir +5 · 1 voice · 2 citations
   Chemistry · Computer Science · #Computational Drug Discovery Methods #Free Radicals and Antioxidants #Various Chemistry Research Topics #physics.chem-ph
7. Iterative charge equilibration for fourth-generation high-dimensional neural network potentials
   2025/02/11 by Emir Kocer, Andreas Singraber, Kocer, Emir +11 · 3 citations
   Computer Science · Physics and Astronomy · #FOS: Physical sciences #Machine Learning and ELM #Materials Science (cond-mat.mtrl-sci) #Quantum Computing Algorithms and Architecture #Quantum and electron transport phenomena
8. Hydrogen Atom Scattering at the Al₂O₃(0001) Surface: A Combined Experimental and Theoretical Study
   2023/12/15 by Liebetrau, Martin, Dorenkamp, Yvonne, Bünermann, Oliver +1 · 1 citation
   #Chemical Physics (physics.chem-ph) #Computational Physics (physics.comp-ph) #FOS: Physical sciences