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Fine tune CHGNet with GGA+U calculations using non-standard U
#220
opened Dec 17, 2024 by
enricosireci
[Bug]: DFT vs CHGNET relaxation
bug
Something isn't working
#213
opened Oct 29, 2024 by
msehabibur
2 of 4 tasks
LAMMPS interface for CHGNet
api
Application programming interface
enhancement
New feature or request
#57
opened Aug 7, 2023 by
advancesoftcorp
ProTip!
Follow long discussions with comments:>50.