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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-24307
  • 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: 24
  • Number of elements: 4
  • Element list: ['Sb', 'Te', 'Cl', 'O']
  • Chemical System: Cl-O-Sb-Te
  • Density: 5.02074385746874
  • Atomic Density: 0.054509510929976364
  • Unit Cell Volume: 440.29013635493294
  • Molar Volume: 11.047871568204165
  • Full Formula: Sb4 Te4 Cl4 O12
  • Reduced Formula: SbTeClO3
  • Formula Anonymous: ABCD3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm