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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1260948
  • Created at: Sept. 4, 2022, 3:41 p.m.
  • Last updated at: Sept. 4, 2022, 3:41 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 14
  • Number of elements: 3
  • Element list: ['N', 'O', 'Zr']
  • Chemical System: N-O-Zr
  • Density: 6.398953434931324
  • Atomic Density: 0.06596771412258982
  • Unit Cell Volume: 212.22502835225382
  • Molar Volume: 9.12892138237331
  • Full Formula: Zr8 N4 O2
  • Reduced Formula: Zr4N2O
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm