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Published 20 hours ago • verified publisher icon usnistgov

Make id_prop.json from vasprun.xml

Open knc6 opened this issue 11 months ago • 1 comments

For force-field training

knc6 avatar Mar 14 '24 19:03 knc6

Take a look: https://colab.research.google.com/gist/knc6/5513b21f5fd83a7943509ffdf5c3608b/make_id_prop.ipynb

knc6 avatar Mar 14 '24 19:03 knc6