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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-70745
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 68
  • Number of elements: 4
  • Element list: ['O', 'P', 'W', 'Zr']
  • Chemical System: O-P-W-Zr
  • Density: 3.9089544106923118
  • Atomic Density: 0.06452215052237738
  • Unit Cell Volume: 1053.9016360965286
  • Molar Volume: 9.333447058481752
  • Full Formula: Zr8 P8 W4 O48
  • Reduced Formula: Zr2P2WO12
  • Formula Anonymous: AB2C2D12
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm