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23 Open 56 Closed
23 Open 56 Closed
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Issues list

🐛 [BUG] InvalidVersion in v0.6.0 bug Something isn't working
#431 opened May 11, 2024 by janosh
1
❓ [QUESTION] How to use hdf5 dataset in config files? question Further information is requested
#422 opened Apr 22, 2024 by OlfwayAdbayIgbay
🌟 [FEATURE] Custom properties enhancement New feature or request
#414 opened Mar 22, 2024 by ThePauliPrinciple
1
minimal extxyz bug Something isn't working
#410 opened Mar 6, 2024 by euhruska
MLFF for Silicon question Further information is requested
#407 opened Feb 7, 2024 by knc6
What is the unit of virials❓ [QUESTION] question Further information is requested
#404 opened Jan 31, 2024 by YuanbinLiu
3
❓ [QUESTION]how can I use the ase calculator for testing ? question Further information is requested
#401 opened Jan 10, 2024 by Clayne2027
❓ [QUESTION]Finetuning Validation Error Higher than Pre-training Error in Nequip question Further information is requested
#398 opened Jan 1, 2024 by ruoywang
how to choose nosehoover the value of nvt_q❓ [QUESTION] question Further information is requested
#397 opened Dec 21, 2023 by hanjiahe1999
bugs with "initialize_from_state"🐛 [BUG] bug Something isn't working
#390 opened Dec 2, 2023 by wwwjjj123yyyy
5
How to do custom EarlyStopping?❓ [QUESTION] question Further information is requested
#380 opened Oct 26, 2023 by ThePauliPrinciple
4
The use of nequip command question Further information is requested
#363 opened Aug 17, 2023 by isseitoida
❓ [QUESTION] Custom layer with control structure not supported? question Further information is requested
#356 opened Jul 28, 2023 by feifzhou
1
🐛 [BUG] Cannot restart run with different dataset bug Something isn't working
#349 opened Jun 27, 2023 by pablo-unzueta
4
issue when using nequip-deploy 🐛 [BUG] bug Something isn't working
#346 opened Jun 6, 2023 by utkarshp1161
9
🌟 [FEATURE] Masking out some labels (e.g. constrained atoms) enhancement New feature or request
#307 opened Feb 21, 2023 by Linux-cpp-lisp
2
🌟 [FEATURE] OpenMM enhancement New feature or request
#288 opened Dec 22, 2022 by asedova
56
❓ [QUESTION] CIF files & other target properties question Further information is requested
#268 opened Nov 22, 2022 by giotre
1
🐛 [BUG] Tutorial example runs infinitely bug Something isn't working
#260 opened Nov 1, 2022 by schiotz
3
Inconsistent runtime error when using a nequip model to preform Langevin Dynamics in ASE🐛 [BUG] question Further information is requested
#232 opened Jul 28, 2022 by NicholasHattrup
5
🐛 [BUG] Crash when using large dataset bug Something isn't working
#214 opened May 23, 2022 by peastman
13
Multi-GPU support exists❓ [QUESTION] enhancement New feature or request
#210 opened May 11, 2022 by JonathanSchmidt1
21
🌟 [FEATURE] Stress tensor enhancement New feature or request
#69 opened Aug 23, 2021 by keano130
@Linux-cpp-lisp
15
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