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Extract Specific Structure Information from OC22
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5
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243
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February 2, 2024
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Predictions of new oxide slabs
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2
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247
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January 29, 2024
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Question about energy of OC20 dataset
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1
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185
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January 25, 2024
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Fine-Tuning An IS2RE DPP model
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9
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605
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January 23, 2024
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Failed to continue training with pretrained IS2RE DPP model
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1
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279
|
January 17, 2024
|
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Error with model: GemNetOC
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2
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186
|
January 12, 2024
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Using ocpapi and getting 504 Timeout error
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3
|
206
|
January 2, 2024
|
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Information on charges and electrons in the OC22 dataset
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1
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230
|
December 22, 2023
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Reference energies for OC22
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1
|
252
|
December 22, 2023
|
|
Pretrained OCP models
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8
|
632
|
November 27, 2023
|
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Ocpapi - high number of predictions
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2
|
285
|
November 20, 2023
|
|
LmdbDataset has no attribute "data"
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6
|
201
|
November 17, 2023
|
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Create OC22lmdbdataset by using OUTCAR（relaxation）
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3
|
257
|
November 14, 2023
|
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OC22 Adsorption Site Information
|
|
1
|
257
|
November 14, 2023
|
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OCP Leaderboard Results Usage
|
|
1
|
203
|
November 14, 2023
|
|
OC22 structures from lmdb
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2
|
299
|
November 8, 2023
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|
Question about size of OC20 dataset
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|
1
|
299
|
November 7, 2023
|
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Using our own data from Vasp with the OCP codebase
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|
5
|
836
|
November 7, 2023
|
|
Submission Guideline
|
|
1
|
266
|
October 10, 2023
|
|
3rd Open Catalyst Challenge @ NeurIPS 2023
|
|
16
|
1830
|
October 10, 2023
|
|
The magnetic moments of the Fe, Co, and Ni systems？
|
|
1
|
270
|
October 4, 2023
|
|
Missing edge index information
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|
3
|
290
|
September 27, 2023
|
|
Maximum force for geometry relaxation
|
|
1
|
261
|
September 22, 2023
|
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OC20-Dense LMDB with relaxed positions
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|
5
|
259
|
September 19, 2023
|
|
Error with environment setting
|
|
1
|
298
|
September 19, 2023
|
|
Test Split True Energies
|
|
1
|
252
|
September 15, 2023
|
|
About the error "'GlobalStorage' object has no attribute 'y_relaxed'"
|
|
1
|
292
|
September 14, 2023
|
|
Relaxed positions from OC20-Dense IS2RE lmdb files
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|
2
|
277
|
September 14, 2023
|
|
Creating Own Pickle file for screened Catalysts
|
|
3
|
310
|
September 13, 2023
|
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Using My Own Data-ASE-Readable Files-POSCAR
|
|
7
|
337
|
September 13, 2023
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