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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1068003
  • Created at: Sept. 4, 2022, 3:42 p.m.
  • Last updated at: Sept. 4, 2022, 3:42 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 16
  • Number of elements: 4
  • Element list: ['N', 'O', 'Zn', 'Zr']
  • Chemical System: N-O-Zn-Zr
  • Density: 5.603627845559103
  • Atomic Density: 0.07232318557960105
  • Unit Cell Volume: 221.22919326320223
  • Molar Volume: 8.326708387826548
  • Full Formula: Zr4 Zn4 N4 O4
  • Reduced Formula: ZrZnNO
  • Formula Anonymous: ABCD
  • Spacegroup Number: 29
  • Spacegroup Symbol: Pca2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2