Data package for "Fast event-driven simulations for soft spheres: from dynamics to Laves phase nucleation"
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下载链接：
https://zenodo.org/record/12608285
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资源简介：
This dataset contains supporting data for the publication:
Fast event-driven simulations for soft spheres: from dynamics to Laves phase nucleation
A. Castagnède, L. Filion, and F. Smallenburg, J. Chem. Phys. 160 (2024), doi:10.1063/5.0209178, arXiv:2403:12755
Contents:
The main folder data_package contains three subfolders: figures, SLNN, and snapshots. The figures subfolder contains supporting data for each of the figures found in the publication, accompanied by details on statepoints and methods in individual README files. The SLNN subfolder contains the trained neural network classifier used in this work for crystalline phase identification, alongside usage instructions and an exemple system to analyze. Finally, the snapshots subfolder contains supplementary snapshots of the crystalline clusters obtained in simulations.
创建时间：
2024-07-01
