README.md

---
dataset_info:
  features:
  - name: pos
    sequence:
      sequence: float32
  - name: atomic_numbers
    sequence: int64
  - name: mu
    dtype: float32
  - name: alpha
    dtype: float32
  - name: eps_HOMO
    dtype: float32
  - name: eps_LUMO
    dtype: float32
  - name: delta_eps
    dtype: float32
  - name: R_2_Abs
    dtype: float32
  - name: ZPVE
    dtype: float32
  - name: U_0
    dtype: float32
  - name: U
    dtype: float32
  - name: H
    dtype: float32
  - name: G
    dtype: float32
  - name: c_v
    dtype: float32
  - name: U_0_ATOM
    dtype: float32
  - name: U_ATOM
    dtype: float32
  - name: H_ATOM
    dtype: float32
  - name: G_ATOM
    dtype: float32
  - name: A
    dtype: float32
  - name: B
    dtype: float32
  - name: C
    dtype: float32
  - name: tags
    sequence: int64
  - name: natoms
    dtype: int64
  - name: id
    dtype: string
  - name: composition
    sequence: int64
  splits:
  - name: train
    num_bytes: 182603296
    num_examples: 110831
  - name: val
    num_bytes: 16467028
    num_examples: 10000
  - name: test
    num_bytes: 16444596
    num_examples: 10000
  download_size: 48643213
  dataset_size: 215514920
configs:
- config_name: default
  data_files:
  - split: train
    path: data/train-*
  - split: val
    path: data/val-*
  - split: test
    path: data/test-*
---