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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-686280
  • 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: 92
  • Number of elements: 4
  • Element list: ['Al', 'C', 'H', 'Si']
  • Chemical System: Al-C-H-Si
  • Density: 0.9365946680209347
  • Atomic Density: 0.08600321847737905
  • Unit Cell Volume: 1069.7274082155222
  • Molar Volume: 7.002227203373756
  • Full Formula: Al2 Si8 H60 C22
  • Reduced Formula: AlSi4H30C11
  • Formula Anonymous: AB4C11D30
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1