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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-88673
  • 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: 32
  • Number of elements: 4
  • Element list: ['Fe', 'P', 'O', 'F']
  • Chemical System: F-Fe-O-P
  • Density: 4.072006340274433
  • Atomic Density: 0.08693510903367523
  • Unit Cell Volume: 368.09064088945314
  • Molar Volume: 6.927167662109057
  • Full Formula: Fe8 P4 O16 F4
  • Reduced Formula: Fe2PO4F
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m