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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-114427
  • 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: 3
  • Number of elements: 3
  • Element list: ['As', 'S', 'F']
  • Chemical System: As-F-S
  • Density: 4.574596962015877
  • Atomic Density: 0.06560034798264375
  • Unit Cell Volume: 45.73146472932928
  • Molar Volume: 9.18004392536654
  • Full Formula: As1 S1 F1
  • Reduced Formula: AsSF
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2