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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-32420
  • 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: 20
  • Number of elements: 4
  • Element list: ['Sb', 'P', 'O', 'F']
  • Chemical System: F-O-P-Sb
  • Density: 3.500286315322511
  • Atomic Density: 0.0705644300072968
  • Unit Cell Volume: 283.4289173445017
  • Molar Volume: 8.534244178514973
  • Full Formula: Sb2 P2 O4 F12
  • Reduced Formula: SbP(OF3)2
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1