Entalpic/LeMat-Ads-H-unknown_data

---
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-*
---