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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-23323
  • 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: 112
  • Number of elements: 4
  • Element list: ['B', 'H', 'Li', 'Zn']
  • Chemical System: B-H-Li-Zn
  • Density: 1.3159892422805994
  • Atomic Density: 0.10468419949878048
  • Unit Cell Volume: 1069.8844767046696
  • Molar Volume: 5.752674031834342
  • Full Formula: Li4 Zn8 B20 H80
  • Reduced Formula: LiZn2(BH4)5
  • Formula Anonymous: AB2C5D20
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm