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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1711966
  • Created at: Sept. 4, 2022, 4 p.m.
  • Last updated at: Sept. 4, 2022, 4 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['H', 'Li', 'Mo']
  • Chemical System: H-Li-Mo
  • Density: 5.633914885034238
  • Atomic Density: 0.16018264550782613
  • Unit Cell Volume: 31.214367724721544
  • Molar Volume: 3.759546323453481
  • Full Formula: Li1 Mo1 H3
  • Reduced Formula: LiMoH3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m