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Issues: materialsvirtuallab/pymatgen-analysis-diffusion
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The calculation results of different systems are different, with a difference of several orders of magnitude
#415
opened Oct 22, 2024 by
Esseco
[Feature Request]: option to select diffusing species when calling get_msd_plot in 'sites' mode
#397
opened Jun 30, 2024 by
okibrisli
1 task done
[Bug]: ValueError: zero-size array to reduction operation maximum which has no identity
bug
#390
opened Jun 1, 2024 by
shwetaphd
1 of 3 tasks
setting n_jobs != 1 raises ValueError: not enough values to unpack (expected 3, got 2)
#343
opened Apr 4, 2023 by
DeeliN221
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