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Upload dataset (part 00001-of-00002)

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  1. README.md +65 -0
  2. data/test_ood-00000-of-00004.parquet +3 -0
  3. data/test_ood-00001-of-00004.parquet +3 -0
  4. data/test_ood-00002-of-00004.parquet +3 -0
  5. data/test_ood-00003-of-00004.parquet +3 -0
  6. data/train-00046-of-00082.parquet +3 -0
  7. data/train-00047-of-00082.parquet +3 -0
  8. data/train-00048-of-00082.parquet +3 -0
  9. data/train-00049-of-00082.parquet +3 -0
  10. data/train-00050-of-00082.parquet +3 -0
  11. data/train-00051-of-00082.parquet +3 -0
  12. data/train-00052-of-00082.parquet +3 -0
  13. data/train-00053-of-00082.parquet +3 -0
  14. data/train-00054-of-00082.parquet +3 -0
  15. data/train-00055-of-00082.parquet +3 -0
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  28. data/train-00068-of-00082.parquet +3 -0
  29. data/train-00069-of-00082.parquet +3 -0
  30. data/train-00070-of-00082.parquet +3 -0
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  39. data/train-00079-of-00082.parquet +3 -0
  40. data/train-00080-of-00082.parquet +3 -0
  41. data/train-00081-of-00082.parquet +3 -0
  42. data/val_id-00000-of-00004.parquet +3 -0
  43. data/val_id-00001-of-00004.parquet +3 -0
  44. data/val_id-00002-of-00004.parquet +3 -0
  45. data/val_id-00003-of-00004.parquet +3 -0
  46. data/val_ood-00000-of-00005.parquet +3 -0
  47. data/val_ood-00001-of-00005.parquet +3 -0
  48. data/val_ood-00002-of-00005.parquet +3 -0
  49. data/val_ood-00003-of-00005.parquet +3 -0
  50. data/val_ood-00004-of-00005.parquet +3 -0
README.md ADDED
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+ ---
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+ dataset_info:
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+ features:
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+ - name: pos
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+ sequence:
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+ sequence: float32
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+ - name: cell
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+ sequence:
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+ sequence:
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+ sequence: float32
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+ - name: atomic_numbers
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+ sequence: int64
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+ - name: natoms
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+ dtype: int64
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+ - name: fixed
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+ sequence: bool
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+ - name: tags
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+ sequence: int64
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+ - name: sid
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+ dtype: int64
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+ - name: fid
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+ dtype: int64
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+ - name: id
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+ dtype: string
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+ - name: oc22
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+ dtype: int64
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+ - name: composition
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+ sequence: int64
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+ - name: y
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+ dtype: float64
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+ - name: force
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+ sequence:
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+ sequence: float32
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+ splits:
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+ - name: test_id
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+ num_bytes: 1934031477
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+ num_examples: 398377
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+ - name: train
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+ - name: val_ood
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+ - name: val_id
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+ num_bytes: 1921311433
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+ num_examples: 394727
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+ - name: test_ood
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+ num_bytes: 1833419571
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+ num_examples: 385438
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+ download_size: 29249462785
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+ dataset_size: 48509068892
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+ configs:
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+ - config_name: default
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+ data_files:
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+ - split: test_id
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+ path: data/test_id-*
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+ - split: train
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+ path: data/train-*
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+ - split: val_ood
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+ path: data/val_ood-*
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+ - split: val_id
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+ path: data/val_id-*
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+ - split: test_ood
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+ path: data/test_ood-*
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+ ---
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