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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-12238
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 7
  • Number of elements: 3
  • Element list: ['I', 'Na', 'O']
  • Chemical System: I-Na-O
  • Density: 3.4654550395909127
  • Atomic Density: 0.04038125034436192
  • Unit Cell Volume: 173.34777750331222
  • Molar Volume: 14.91321023654439
  • Full Formula: Na4 I2 O1
  • Reduced Formula: Na4I2O
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm