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Apr 4 2024 nbsp 0183 32 ABACUS DeePMD DPGEN LAMMPS ABACUS ABACUS DPGEN Mar 4, 2025 · ABACUS还支持杂化泛函方法（PBE0、HSE06），支持接入机器学习泛函DeePKS和机器学习势DeePMD， 并支持跑MD，以及在MD中调用FIRE方法进行优化。
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Abacus Software DownloadMay 22, 2023 · 2024-02-19更新本帖上方法已经内嵌到ABACUS的toolchain中，可以直接在ABACUS仓库使用toolchain安装ABACUS。欢迎大家试用国产DFT软件并积极提出建议遇见！ … Oct 4 2024 nbsp 0183 32 MD Molecular Modeling Return Views 988 Reply 9
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