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Welcome to Discourse
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3
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1324
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June 17, 2021
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Opening LMDB files
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10
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968
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June 5, 2023
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Interface of S2EF for LAMMPS
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3
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619
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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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25
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May 22, 2023
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About calculating stress
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0
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46
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May 10, 2023
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Lmdb转换：什么格式可以转换成lmdb
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0
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58
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April 25, 2023
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通过读取is2re的lmdb数据集
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2
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67
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April 22, 2023
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Adsorption energy
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9
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683
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April 14, 2023
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Nosé–Hoover MD calculation by OCPcalculator
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1
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167
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February 27, 2023
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Unable to avoid below error
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2
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124
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February 25, 2023
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Help for a new scientist
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1
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189
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February 8, 2023
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EvalAI Submissions stuck on "Running"
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1
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100
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January 23, 2023
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Is there a way to accelerate IS2RS task optimization speed
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1
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187
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November 10, 2022
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Open Catalyst Challenge session @ NeurIPS 2022
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2
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249
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January 9, 2023
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CCAI - OCP Tutorial not being able to run
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0
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132
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January 5, 2023
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IS2RE Leaderboard Concerns
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3
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800
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January 4, 2023
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Scaling Laws Meets Cost of Data
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0
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122
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December 20, 2022
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Open Catalyst Challenge session @ NeurIPS 2021
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1
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536
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November 29, 2022
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Unit of adsorption energies
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2
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176
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November 25, 2022
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OC20 S2EF 200K Training Errors
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1
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165
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November 20, 2022
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Optionally download dataset
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3
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163
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November 20, 2022
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2nd Open Catalyst Challenge @ NeurIPS 2022
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24
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1087
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November 15, 2022
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What is exactly out of domain in the OOD splits?
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1
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166
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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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183
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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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627
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October 7, 2022
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Welcome to the discussion board!
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6
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533
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October 5, 2022
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OCPCalculator ASE
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4
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221
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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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416
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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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177
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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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222
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September 27, 2022
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