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Optionally download dataset
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3
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426
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November 20, 2022
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What is exactly out of domain in the OOD splits?
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1
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441
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October 12, 2022
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How to upload engineered descriptor derived dataset (.csv files), model (train, validation, test) scripts and associated scripts on evaluation server?
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4
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488
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October 7, 2022
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Open Catalyst 2022 (OC22) Dataset: Oxide Electrocatalysis
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5
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1340
|
October 7, 2022
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Welcome to the discussion board!
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6
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886
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October 5, 2022
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OCPCalculator ASE
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4
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664
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September 30, 2022
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Open Catalyst challenge deadline in a month!
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5
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706
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September 28, 2022
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Calculate the stress-tensor of all the atoms
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2
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390
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September 28, 2022
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Which POTCARs are used in OC20?
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2
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525
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September 27, 2022
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Molecular Dynamics data
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1
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472
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September 13, 2022
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Batch_to_atoms error
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2
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400
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August 31, 2022
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How to construct ASE atoms object from LMDB dataset?
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5
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1125
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August 25, 2022
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Vasp parameters for OCP dataset generation
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5
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622
|
August 15, 2022
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NeurIPS ‘21 Challenge Updates
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10
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1456
|
September 27, 2021
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OC22 Discussion Zoom Session
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2
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663
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July 11, 2022
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Minimum Physics/Chemical/Material science knowledge
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2
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509
|
June 27, 2022
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Bader charges and LOBSTER analyses on relaxed structures
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9
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1262
|
June 21, 2022
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Updates on NeurIPS 22?
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3
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462
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May 30, 2022
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Interpreting IS2RE results (MAE, EwT)
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4
|
519
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May 17, 2022
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The size of preprocessed data compared to raw .xz files
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1
|
440
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May 16, 2022
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(No)oxides in database
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3
|
539
|
April 22, 2022
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Using adsorbate data to train models
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13
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955
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February 1, 2022
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Data augmentation in ForceNet
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4
|
700
|
January 17, 2022
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Open Catalyst Project @ NeurIPS Climate Change AI Workshop
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2
|
762
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January 14, 2022
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About the reference energy
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6
|
819
|
January 13, 2022
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OCP Colab Tutorial
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1
|
813
|
January 11, 2022
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Catalysts without adsorbents
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3
|
780
|
January 11, 2022
|
|
Number of submissions to the leaderboard
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1
|
572
|
December 8, 2021
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New GemNet-dT code, results, model weights
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10
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1996
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December 7, 2021
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Make adsorbate initial structures in CatKit
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1
|
688
|
November 9, 2021
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