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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-115307
  • 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: 5
  • Number of elements: 3
  • Element list: ['Sb', 'S', 'O']
  • Chemical System: O-S-Sb
  • Density: 6.217263973862457
  • Atomic Density: 0.06086347656413565
  • Unit Cell Volume: 82.15107454026534
  • Molar Volume: 9.894506689334602
  • Full Formula: Sb2 S1 O2
  • Reduced Formula: Sb2SO2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm