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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-688244
  • Created at: Sept. 4, 2022, 3:52 p.m.
  • Last updated at: Sept. 4, 2022, 3:52 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 88
  • Number of elements: 5
  • Element list: ['Ag', 'C', 'H', 'O', 'S']
  • Chemical System: Ag-C-H-O-S
  • Density: 2.22008097929598
  • Atomic Density: 0.09451802048727437
  • Unit Cell Volume: 931.0393885348886
  • Molar Volume: 6.371420739615261
  • Full Formula: Ag4 H44 C16 S12 O12
  • Reduced Formula: AgH11C4(SO)3
  • Formula Anonymous: AB3C3D4E11
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m