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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22127
  • 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: 15
  • Number of elements: 4
  • Element list: ['Na', 'Zr', 'Zn', 'F']
  • Chemical System: F-Na-Zn-Zr
  • Density: 3.6570149962121916
  • Atomic Density: 0.06884655687047495
  • Unit Cell Volume: 217.87581953038517
  • Molar Volume: 8.747192356082243
  • Full Formula: Na1 Zr2 Zn1 F11
  • Reduced Formula: NaZr2ZnF11
  • Formula Anonymous: ABC2D11
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m