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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-42714
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 24
  • Number of elements: 3
  • Element list: ['Fe', 'O', 'F']
  • Chemical System: F-Fe-O
  • Density: 4.951867017272989
  • Atomic Density: 0.09930013275848808
  • Unit Cell Volume: 241.69151977239935
  • Molar Volume: 6.064584802365468
  • Full Formula: Fe8 O10 F6
  • Reduced Formula: Fe4O5F3
  • Formula Anonymous: A3B4C5
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1