@misc{indiciaee2f3a6855fc1, title = {Unsupervised atomic data mining via multi-kernel graph autoencoders for machine learning force fields}, author = {Sun, Hong [Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States)] and Vita, Joshua A [Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States)] (ORCID:000000019191055X) and Samanta, Amit [Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States)] and Lordi, Vincenzo [Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States)] (ORCID:0000000324154656)}, year = {2026}, doi = {10.1088/2632-2153/ae39a1}, url = {https://www.osti.gov/biblio/3022812}, note = {Source identifier: 3022812} }