AL4GAP: Active learning workflow for generating DFT-SCAN accurate machine-learning potentials for combinatorial molten salt mixtures

Jicheng Guo, Vanessa Woo, David A. Andersson, Nathaniel Hoyt, Mark Williamson, Ian Foster, Chris Benmore, Nicholas E. Jackson, Ganesh Sivaraman

Research output: Contribution to journal › Article › peer-review

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Physics

Computer Science

Chemistry

Chemical Engineering