Closed Atefeh-Yadegarifard closed 6 months ago
Hi,
The issue comes from the dependency in ase.filters
Please refer to ase install in the release
Before the official release of ASE
pypi package, the installation can only be accessable from gitlab.
The update in the v0.3.3 is to implemente the new FrechetCellFilter
in StructOptimizer
for better relaxation accuracy and speed.
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Version
0.3.3
Which OS(es) are you using?
What happened?
Hello. I have installed the latest version of chgnet and I am unable to initialize it. chgnet version 0.3.3 ase version 3.22.1
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