Maximizing Efficiency of Dataset Compression for Machine Learning Potentials With Information Theory
机构 * Department of Materials Science and Engineering, University of California, Los Angeles, CA, United States(加州大学洛杉矶分校材料科学与工程系) ; Materials Science Division, Lawrence Livermore National Laboratory, CA, United States(劳伦斯利弗莫尔国家实验室材料科学部)
Comments main text + SI; code at https://github.com/dskoda/quests