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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-10253
  • 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: 10
  • Number of elements: 4
  • Element list: ['As', 'S', 'N', 'F']
  • Chemical System: As-F-N-S
  • Density: 2.8603576674067153
  • Atomic Density: 0.06450312345486531
  • Unit Cell Volume: 155.03125219970607
  • Molar Volume: 9.336200229456898
  • Full Formula: As1 S2 N1 F6
  • Reduced Formula: AsS2NF6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m