Supplementary Data: Multistage nucleation pathway in LiF molten salt mirrors the crystal-melt interface structure
<p dir="ltr">i) The files for the ACE-SCAN potential of LiF</p><p dir="ltr">ii) The associated training and test datasets of the ACE-SCAN potential</p><p dir="ltr">iii) The exemplary LAMMPS input file of using the ACE-SCAN potential as well...
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2025
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| 總結: | <p dir="ltr">i) The files for the ACE-SCAN potential of LiF</p><p dir="ltr">ii) The associated training and test datasets of the ACE-SCAN potential</p><p dir="ltr">iii) The exemplary LAMMPS input file of using the ACE-SCAN potential as well as the associated output files</p><p dir="ltr">If the ACE-SCAN potential and/or its training dataset are useful for your research, please cite: Z. Fan, D. Rawat, P. Zarzycki, M.L. Whittaker, & M. Asta, Multistage nucleation pathway in LiF molten salt mirrors the crystal–melt interface structure, Proc. Natl. Acad. Sci. U.S.A. 122 (25) e2425702122, https://doi.org/10.1073/pnas.2425702122 (2025).</p><p dir="ltr">Please contact Zhao (zfan2016@gmail.com) if there is any question on the ACE-SCAN potential and/or its training dataset. </p> |
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