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21 Open 264 Closed
21 Open 264 Closed
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Issues list

Atomic energies for OMAT24
#1054 opened Mar 10, 2025 by tomdemeyere
@lbluque
1
Documentation for how to use quacc to predict inorganic material properties with OMAT documentation Improvements or additions to documentation enhancement New feature or request good first issue Good for newcomers patch Patch version release
#1045 opened Mar 3, 2025 by zulissimeta
@zulissimeta
Cannot find the bulks.pkl file
#1041 opened Feb 28, 2025 by GuideBariri
2
What is the energy reference of OCPCalculator ?
#1036 opened Feb 26, 2025 by MSJavaScript
2
Error importing Open Catalyst 2022 LMDB files bug Something isn't working
#1031 opened Feb 25, 2025 by allaffa
AssertionError: 'coefficient' is not defined in the energy loss config {'fn': 'mae'}.
#1028 opened Feb 25, 2025 by yxwang1215
2
How to use OC20 IS2RE Dimnet++ checkpoint
#1027 opened Feb 23, 2025 by liudean998
1
How to combine OC22 and OC20 dataset for model training using fairchem?
#1026 opened Feb 23, 2025 by zouzihan123
@mshuaibii
Precision Issue with Linear Reference bug Something isn't working
#1024 opened Feb 21, 2025 by tkreiman
1
OMAT-DFT labels for the WBM test set.
#1022 opened Feb 18, 2025 by rdguha66
@lbluque
3
AdsorbML: using slab without bulk information?
#1021 opened Feb 18, 2025 by goodwilling
@mshuaibii
1
Questions on comparing OCP to CASTEP DFT measurements for screening oxides
#1015 opened Feb 14, 2025 by hcenge
1
Export escn_l6_m2_lay12_2M_s2ef_export_cuda_9182024 using aot_inductor stale
#1000 opened Feb 6, 2025 by ipcamit
@rayg1234
2
OCPNEB surface facet index mismatch
#988 opened Jan 31, 2025 by jungsdao
@mshuaibii @brookwander
3
Remove numpy<2 pin stale
#984 opened Jan 28, 2025 by janosh
@lbluque
6
ModuleNotFoundError: No module named 'fairchem.core' stale
#982 opened Jan 27, 2025 by hydrogen1222
@lbluque
4
Problem in reading the LMDB dataset question Further information is requested stale
#979 opened Jan 22, 2025 by vishank-u
7
How to train ML model in open source code for new MOLECULES adsorption question Further information is requested
#959 opened Jan 6, 2025 by PhuongDongUSTH
6
Issue in ML NEB Run (cattsunami) question Further information is requested
#946 opened Dec 18, 2024 by K-Manan
@mshuaibii @brookwander @zulissimeta
5
Rename OCPCalculator to FAIRChemCalculator or similar dont-close enhancement New feature or request good first issue Good for newcomers
#721 opened Jun 3, 2024 by zulissimeta
1
main.py issues/improvements for mass inference with an ase-db with a checkpoint dont-close enhancement New feature or request
#539 opened Jul 21, 2023 by jkitchin
2
ProTip! Follow long discussions with comments:>50.