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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-36221
  • 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: 56
  • Number of elements: 4
  • Element list: ['Ba', 'Cd', 'S', 'Sn']
  • Chemical System: Ba-Cd-S-Sn
  • Density: 4.103834985573667
  • Atomic Density: 0.03482873310523375
  • Unit Cell Volume: 1607.8678437943186
  • Molar Volume: 17.290725855012642
  • Full Formula: Ba8 Cd8 Sn8 S32
  • Reduced Formula: BaCdSnS4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 43
  • Spacegroup Symbol: Fdd2
  • Crystal System: orthorhombic
  • Pointgroup: mm2