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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1095681
  • Created at: Sept. 4, 2022, 3:46 p.m.
  • Last updated at: Sept. 4, 2022, 3:46 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 4
  • Element list: ['O', 'P', 'Zn', 'Zr']
  • Chemical System: O-P-Zn-Zr
  • Density: 5.061194206619331
  • Atomic Density: 0.05987878487978395
  • Unit Cell Volume: 133.60324555785917
  • Molar Volume: 10.057219384278408
  • Full Formula: Zr2 Zn2 P2 O2
  • Reduced Formula: ZrZnPO
  • Formula Anonymous: ABCD
  • Spacegroup Number: 26
  • Spacegroup Symbol: Pmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2