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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-11745
  • Created at: Sept. 4, 2022, 3:17 p.m.
  • Last updated at: Sept. 4, 2022, 3:17 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 31
  • Number of elements: 5
  • Element list: ['Cl', 'Na', 'O', 'P', 'Zr']
  • Chemical System: Cl-Na-O-P-Zr
  • Density: 2.9180764854416417
  • Atomic Density: 0.07635426915972973
  • Unit Cell Volume: 406.0021835209945
  • Molar Volume: 7.887104187196068
  • Full Formula: Na9 Zr1 P4 Cl1 O16
  • Reduced Formula: Na9ZrP4ClO16
  • Formula Anonymous: ABC4D9E16
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1