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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-23327
  • Created at: Sept. 4, 2022, 2:49 p.m.
  • Last updated at: Sept. 4, 2022, 2:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 11
  • Number of elements: 4
  • Element list: ['C', 'H', 'Li', 'O']
  • Chemical System: C-H-Li-O
  • Density: 2.0127557087338626
  • Atomic Density: 0.11697518299136875
  • Unit Cell Volume: 94.03704032514023
  • Molar Volume: 5.14822084992537
  • Full Formula: Li1 H3 C2 O5
  • Reduced Formula: LiH3C2O5
  • Formula Anonymous: AB2C3D5
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1