MatPL
Material Potential Library (MatPL) (formerly known as PWMLFF, https://github.com/LonxunQuantum/PWMLFF) is an open-source software package under the GNU GPL license, designed to rapidly generate machine learning force fields with accuracy comparable to Ab Initio Molecular Dynamics (AIMD).
Install / Use
/learn @LonxunQuantum/MatPLREADME
Machine Learning Force Field
Introduction:
MatPL(PWMLFF) is an open source software under GNU GPL license. It aims at generating force fields with accuracy comparable to Ab Initio Molecular Dynamics (AIMD). It is compatible with AIMD data in either PWmat or VASP format.
Manual
A complete user manual can be found here: http://doc.lonxun.com/MatPL/
2025/9/22
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