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Test Split True Energies
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1
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253
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September 15, 2023
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About the error "'GlobalStorage' object has no attribute 'y_relaxed'"
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1
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295
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September 14, 2023
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Relaxed positions from OC20-Dense IS2RE lmdb files
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2
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279
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September 14, 2023
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Creating Own Pickle file for screened Catalysts
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3
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312
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September 13, 2023
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Using My Own Data-ASE-Readable Files-POSCAR
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7
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344
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September 13, 2023
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Will the test dataset also include metadata?
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3
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292
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September 11, 2023
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Run S2EF with-all equiformerV2 with error "pickle environment"
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0
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231
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September 11, 2023
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Scale factor error - Using the IS2RE gemet model -
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2
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288
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September 10, 2023
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Which dataset can be used for challenge?
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1
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343
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August 31, 2023
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Converting LMDB to ASE object
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5
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366
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August 31, 2023
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Adsorption energy
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11
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1622
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August 29, 2023
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Calculation of Adsorbtion energies under applied potential
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0
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329
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August 10, 2023
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Reading LMDB files: field interpretations
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0
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460
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August 6, 2023
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How to translate the dataset to OCP format and fit it on S2EF Task
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0
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292
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August 6, 2023
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How to calculate adsorption energy using OCPCalculator.
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2
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467
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August 4, 2023
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Predicting adsorption energy
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0
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319
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August 3, 2023
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OC20 and OC22 。The two data sets contain different attributes. Why is this Wae Ireoni? Or, what are the differences and connections between the two datasets?
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0
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295
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August 3, 2023
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Which elements used to build OC20?
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5
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374
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August 3, 2023
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2nd Open Catalyst Challenge @ NeurIPS 2022
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27
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1868
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July 27, 2023
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Prediction of adsorption energies for oxide materials
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0
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345
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July 27, 2023
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OC20 S2EF 200K Training Errors
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2
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548
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July 22, 2023
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RuntimeError: Failed to find the model 'gemnet_t'
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1
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284
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July 19, 2023
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Lmdb转换：什么格式可以转换成lmdb
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1
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471
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July 18, 2023
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Calculating Adsorbtion and relaxation energies of Aqueos state Catalysis
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2
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372
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July 12, 2023
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Opening LMDB files
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11
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2981
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July 12, 2023
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OC22 dft-configurations
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0
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342
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July 3, 2023
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Constraints in OC22 trajectories dataset
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1
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329
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June 29, 2023
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Torch/nccl version dismatch
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4
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719
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June 26, 2023
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Interface of S2EF for LAMMPS
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3
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1105
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May 25, 2023
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怎么使用多GPU训练GemNet模型
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0
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310
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May 22, 2023
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