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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-34206
  • 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: 9
  • Number of elements: 4
  • Element list: ['Na', 'S', 'O', 'F']
  • Chemical System: F-Na-O-S
  • Density: 1.4346984872170245
  • Atomic Density: 0.042253694910938035
  • Unit Cell Volume: 212.99912395756445
  • Molar Volume: 14.252341180323794
  • Full Formula: Na3 S1 O4 F1
  • Reduced Formula: Na3SO4F
  • Formula Anonymous: ABC3D4
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m