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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-36313
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 60
  • Number of elements: 4
  • Element list: ['Cl', 'O', 'S', 'Sb']
  • Chemical System: Cl-O-S-Sb
  • Density: 2.151594944172313
  • Atomic Density: 0.03400577702306526
  • Unit Cell Volume: 1764.4060878039493
  • Molar Volume: 17.709169697593836
  • Full Formula: Sb4 S32 Cl20 O4
  • Reduced Formula: SbS8Cl5O
  • Formula Anonymous: ABC5D8
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm