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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-110394
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Zn', 'O', 'F']
  • Chemical System: F-O-Zn
  • Density: 3.2554486128701123
  • Atomic Density: 0.07239328968067349
  • Unit Cell Volume: 138.13434980106527
  • Molar Volume: 8.318644982930929
  • Full Formula: Zn2 O4 F4
  • Reduced Formula: Zn(OF)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m