Issue date: 2023
Kussainova, Dina & Panagiotopoulos, Athanassios. (2023). Data from "Molecular Simulation of Lithium Carbonate Reactive Vapor-Liquid Equilibria using a Deep Potential Model" [Data set]. Princeton University. https://doi.org/10.34770/c6dc-3d45
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Description: Data and input files related to the paper "Molecular Simulation of Lithium Carbonate Reactive Vapor-Liquid Equilibria using a Deep Potential Model". This includes example LAMMPS and CP2K files for NPT and NVT simulations, as well as the generated DP model used to perform all DPMD simulations.
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