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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1759377
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 20
  • Number of elements: 3
  • Element list: ['Cd', 'H', 'Na']
  • Chemical System: Cd-H-Na
  • Density: 4.020347368758463
  • Atomic Density: 0.08745230126040916
  • Unit Cell Volume: 228.69609732104638
  • Molar Volume: 6.886200446650001
  • Full Formula: Na4 Cd4 H12
  • Reduced Formula: NaCdH3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm