Efficient and Accurate Machine Learning Interatomic Potential for Graphene: Capturing Stress

10023 2025 eng 16319 16326 129 article 0 -- -- -- Efficient and Accurate Machine Learning Interatomic Potential for Graphene: Capturing Stress–Strain and Vibrational Properties The Journal of Physical Chemistry C 2505.12140 10.1021/acs.jpcc.5c03470 publish yes Felipe Hawthorne Ronaldo Rodrigues Pela Paulo R. E. Raulino Ronaldo Rodrigues Pelá Cristiano F. Woellner Distributed Algorithms and Supercomputing Supercomputing Rodrigues Pelá, Ronaldo NHR@ZIB