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29 Open 182 Closed
29 Open 182 Closed
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Issues list

Discrepancy in PotEng Between lmp-otf MD and Single-Point OTF/DFT for Water Molecules
#432 opened Nov 29, 2024 by ShuaishuaiYuan
offline training of the Pt/H
#431 opened Nov 26, 2024 by hewuanhewuan
Structure(cell, coded_species, pos, cutoff, descriptors) MemoryError: std::bad_alloc
#429 opened Nov 18, 2024 by siinghim
Use descriptor-space mapping in ASE
#428 opened Nov 9, 2024 by FromColleWithLove
1
Compilation error when building LAMMPS pair_flare_kokkos
#427 opened Nov 5, 2024 by namehta4
2
What happens when using three kernels and corresponding three descriptors, but only adding a two-dimensional sparse environment?
#425 opened Nov 1, 2024 by rbjiawen
1
Executing flare-otf lammps.yaml on the command line results in an error
#424 opened Oct 28, 2024 by 915936476
1
AssertionError thermostat.shape
#405 opened Jul 12, 2024 by rsdmse
1
Hyperparameter optimization giving abnormally high energy noise
#403 opened Jul 5, 2024 by MorAnyAn
Supercell selection in offline training for 2 different systems
#399 opened Apr 25, 2024 by taidbui
Wrong parsing of the results which sticks numbers together.
#398 opened Apr 18, 2024 by gjoalland13
Can't access tutorial notebooks on Colab
#396 opened Mar 13, 2024 by taidbui
7
Google Colab FLARE+LAMMPS crashing
#389 opened Jan 4, 2024 by francescomambretti
3
Can't clone flare on windows because of tests/test_files/output_files/. Possibly OUTCAR naming not allowed on windows
#388 opened Jan 1, 2024 by NicholasDow
1
Bug: Python API cannot save trained model (Segmentation fault, list index out of range)
#386 opened Dec 6, 2023 by m-a-saleh
8
Execluding some species from training
#385 opened Dec 4, 2023 by m-a-saleh
1
seg fault when predicting local uncertainty with trained sgp calculator
#379 opened Sep 28, 2023 by aaronchen0316
4
Is the specific coarse-grain version available？
#378 opened Sep 26, 2023 by shuhaom
1
Output file inquire
#377 opened Sep 23, 2023 by Lan-Tech-ISU
3
OTF SGP models with force_only=True, not working with OTF.from_checkpint()
#376 opened Sep 22, 2023 by usaleem97
2
Trajectory extraction
#375 opened Sep 19, 2023 by KrishnanjanP
7
Time of Update GP (s) increases a lot as more DFT calls
#372 opened Sep 3, 2023 by YukeLi-chem
1
Coogle colab tutorial is missing
#371 opened Aug 21, 2023 by m-a-saleh
2
raise RuntimeError("Failed to retrieve any thermo_style-output")
#360 opened Jul 2, 2023 by YukeLi-chem
3
Problem running otf_train.yaml (error message sparse_gp.py)
#359 opened Jun 30, 2023 by johnemec
4
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