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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97882
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 50
  • Number of elements: 5
  • Element list: ['Zn', 'Bi', 'P', 'O', 'F']
  • Chemical System: Bi-F-O-P-Zn
  • Density: 7.497952823884832
  • Atomic Density: 0.06869671423047509
  • Unit Cell Volume: 727.836848677387
  • Molar Volume: 8.76627190610009
  • Full Formula: Zn2 Bi12 P4 O28 F4
  • Reduced Formula: ZnBi6P2(O7F)2
  • Formula Anonymous: AB2C2D6E14
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m