Data for Dimethoxyethane Parameterizations and the Effect of Dihedral Parameters on Modeling Lithium Transport
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Simulation inputs (initial configurations and LAMMPS submission scripts) to reproduce the molecular dynamics simulations reported in: Emily Crabb, Dimethoxyethane Parameterizations and the Effect of Dihedral Parameters on Modeling Lithium Transport (submitted) Output files for the TRAVIS analysis performed on the NVT simulations and output files containing the average densities for the NPT simulations are also included.
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Zenodo创建时间：
2026-09-28
