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dpdata-minimizer

Minimize geometries with dpdata minimizer plugins via System.minimize(), including how minimizers relate to drivers (ASEMinimizer needs a dpdata Driver) and how to list supported minimizers (ase/sqm). Use when doing geometry optimization/minimization through dpdata Python API.

查看源碼framework-internals
deepmodeling
maintainer
deepmodeling
更新於 3/18/2026
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quick start

Installation and usage

Minimize geometries with dpdata minimizer plugins via System.minimize(), including how minimizers relate to drivers (ASEMinimizer needs a dpdata Driver) and how to list supported minimizers (ase/sqm). Use when doing geometry optimization/minimization through dpdata Python API.

安裝
$ install --globalskills.sh
使用

安裝後，您可以通過在終端運行以下命令來使用此技能：

skills use dpdata-minimizer