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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-55452
  • Created at: Sept. 4, 2022, 3:18 p.m.
  • Last updated at: Sept. 4, 2022, 3:18 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 36
  • Number of elements: 3
  • Element list: ['Cs', 'I', 'Zn']
  • Chemical System: Cs-I-Zn
  • Density: 3.9962249721853005
  • Atomic Density: 0.019714460110485655
  • Unit Cell Volume: 1826.0708027633204
  • Molar Volume: 30.546820588796983
  • Full Formula: Cs12 Zn4 I20
  • Reduced Formula: Cs3ZnI5
  • Formula Anonymous: AB3C5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm