Data from "Ab initio machine-learning simulation of calcium carbonate from aqueous solutions to the solid state"
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Analysis and input files to reproduce simulations of manuscript "Ab initio machine learning simulation of calcium carbonate from aqueous solutions to the solid state" by Piaggi, Gale, and Raiteri, Proc. Natl. Acad. Sci. 122, e2415663122 (2025) https://doi.org/10.1073/pnas.2415663122
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Zenodo创建时间：
2026-01-15
