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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-23467
  • Created at: Sept. 4, 2022, 2:49 p.m.
  • Last updated at: Sept. 4, 2022, 2:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 136
  • Number of elements: 3
  • Element list: ['C', 'H', 'Si']
  • Chemical System: C-H-Si
  • Density: 1.0427665663503443
  • Atomic Density: 0.12100470164259287
  • Unit Cell Volume: 1123.923270367611
  • Molar Volume: 4.976782454112714
  • Full Formula: Si8 H96 C32
  • Reduced Formula: Si(H3C)4
  • Formula Anonymous: AB4C12
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3