---
dataset_info:
  features:
  - name: publication
    dtype: string
  - name: equation
    dtype: string
  - name: reaction_energy
    dtype: float64
  - name: miller_index
    list: float64
  - name: sites
    dtype: string
  - name: other_structure
    list:
    - name: cartesian_site_positions
      list:
        list: float64
    - name: chemical_formula_anonymous
      dtype: string
    - name: chemical_formula_descriptive
      dtype: string
    - name: chemical_formula_reduced
      dtype: string
    - name: dimension_types
      list: int64
    - name: elements
      list: string
    - name: elements_ratios
      list: float64
    - name: immutable_id
      dtype: string
    - name: lattice_vectors
      list:
        list: float64
    - name: nelements
      dtype: int64
    - name: nperiodic_dimensions
      dtype: int64
    - name: nsites
      dtype: int64
    - name: species
      list:
      - name: attached
        dtype: 'null'
      - name: chemical_symbols
        list: string
      - name: concentration
        list: int64
      - name: mass
        dtype: 'null'
      - name: name
        dtype: string
      - name: nattached
        dtype: 'null'
      - name: original_name
        dtype: 'null'
    - name: species_at_sites
      list: string
    - name: system_name
      dtype: string
  - name: other_structure_energy
    list: float64
  - name: reactant_slab
    list:
    - name: cartesian_site_positions
      list:
        list: float64
    - name: chemical_formula_anonymous
      dtype: string
    - name: chemical_formula_descriptive
      dtype: string
    - name: chemical_formula_reduced
      dtype: string
    - name: dimension_types
      list: int64
    - name: elements
      list: string
    - name: elements_ratios
      list: float64
    - name: immutable_id
      dtype: string
    - name: lattice_vectors
      list:
        list: float64
    - name: nelements
      dtype: int64
    - name: nperiodic_dimensions
      dtype: int64
    - name: nsites
      dtype: int64
    - name: species
      list:
      - name: attached
        dtype: 'null'
      - name: chemical_symbols
        list: string
      - name: concentration
        list: int64
      - name: mass
        dtype: 'null'
      - name: name
        dtype: string
      - name: nattached
        dtype: 'null'
      - name: original_name
        dtype: 'null'
    - name: species_at_sites
      list: string
    - name: system_name
      dtype: string
  - name: reactant_slab_energy
    list: float64
  - name: product_slab
    list: 'null'
  - name: product_slab_energy
    list: float64
  - name: reactant_molecule
    list:
    - name: cartesian_site_positions
      list:
        list: float64
    - name: chemical_formula_anonymous
      dtype: string
    - name: chemical_formula_descriptive
      dtype: string
    - name: chemical_formula_reduced
      dtype: string
    - name: dimension_types
      list: int64
    - name: elements
      list: string
    - name: elements_ratios
      list: float64
    - name: immutable_id
      dtype: string
    - name: lattice_vectors
      list:
        list: float64
    - name: nelements
      dtype: int64
    - name: nperiodic_dimensions
      dtype: int64
    - name: nsites
      dtype: int64
    - name: species
      list:
      - name: attached
        dtype: 'null'
      - name: chemical_symbols
        list: string
      - name: concentration
        list: int64
      - name: mass
        dtype: 'null'
      - name: name
        dtype: string
      - name: nattached
        dtype: 'null'
      - name: original_name
        dtype: 'null'
    - name: species_at_sites
      list: string
    - name: system_name
      dtype: string
  - name: reactant_molecule_energy
    list: float64
  - name: product_molecule
    list: 'null'
  - name: product_molecule_energy
    list: float64
  - name: reactant_adslab
    list: 'null'
  - name: reactant_adslab_energy
    list: float64
  - name: product_adslab
    list:
    - name: cartesian_site_positions
      list:
        list: float64
    - name: chemical_formula_anonymous
      dtype: string
    - name: chemical_formula_descriptive
      dtype: string
    - name: chemical_formula_reduced
      dtype: string
    - name: dimension_types
      list: int64
    - name: elements
      list: string
    - name: elements_ratios
      list: float64
    - name: immutable_id
      dtype: string
    - name: lattice_vectors
      list:
        list: float64
    - name: nelements
      dtype: int64
    - name: nperiodic_dimensions
      dtype: int64
    - name: nsites
      dtype: int64
    - name: species
      list:
      - name: attached
        dtype: 'null'
      - name: chemical_symbols
        list: string
      - name: concentration
        list: int64
      - name: mass
        dtype: 'null'
      - name: name
        dtype: string
      - name: nattached
        dtype: 'null'
      - name: original_name
        dtype: 'null'
    - name: species_at_sites
      list: string
    - name: system_name
      dtype: string
  - name: product_adslab_energy
    list: float64
  - name: reactant_other
    list: 'null'
  - name: reactant_other_energy
    list: 'null'
  - name: product_other
    list: 'null'
  - name: product_other_energy
    list: 'null'
  - name: __index_level_0__
    dtype: int64
  - name: processed_reaction_energy
    dtype: float64
  - name: processed_reactant_slab_energy
    dtype: float64
  - name: processed_reactant_molecule_energy
    dtype: float64
  - name: processed_product_adslab_energy
    dtype: float64
  - name: adslab_tags
    list: int64
  splits:
  - name: train
    num_bytes: 44705707
    num_examples: 13513
  download_size: 9719336
  dataset_size: 44705707
configs:
- config_name: default
  data_files:
  - split: train
    path: data/train-*
---