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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-111751
  • Created at: Sept. 4, 2022, 3:18 p.m.
  • Last updated at: Sept. 4, 2022, 3:18 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 36
  • Number of elements: 7
  • Element list: ['C', 'H', 'K', 'N', 'O', 'Os', 'S']
  • Chemical System: C-H-K-N-O-Os-S
  • Density: 2.993352757345537
  • Atomic Density: 0.0657266386010312
  • Unit Cell Volume: 547.723126668997
  • Molar Volume: 9.16240490641114
  • Full Formula: K6 H4 Os2 C8 S2 N8 O6
  • Reduced Formula: K3H2OsC4SN4O3
  • Formula Anonymous: ABC2D3E3F4G4
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1