A practical guide to machine learning interatomic potentials – Status and future
Ryan Jacobs, Dane Morgan, Siamak Attarian, Jun Meng, Chen Shen, Zhenghao Wu, Clare Yijia Xie, Julia H. Yang, Nongnuch Artrith, Ben Blaiszik, Gerbrand Ceder, Kamal Choudhary, Gábor Csányi, Ekin D. Cubuk, Bowen Deng, Ralf Drautz, Xiang Fu, Jonathan Godwin, Vasant Honavar, Olexandr Isayev, Anders Johansson, Boris Kozinsky, Stefano Martiniani, Shyue Ping Ong, Igor Poltavsky, KJ Schmidt, So Takamoto, Aidan P. Thompson, Julia Westermayr, Brandon M. Wood
Topics & Concepts
Interatomic potentialComputer scienceData scienceChemistryComputational chemistryMolecular dynamicsMachine Learning in Materials ScienceAdvanced Materials Characterization TechniquesHydrogen embrittlement and corrosion behaviors in metals