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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1464620
  • 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: 6
  • Number of elements: 3
  • Element list: ['Ac', 'B', 'Ru']
  • Chemical System: Ac-B-Ru
  • Density: 9.012749258280255
  • Atomic Density: 0.08770374080164917
  • Unit Cell Volume: 68.41213322439238
  • Molar Volume: 6.866458266152725
  • Full Formula: Ac1 B4 Ru1
  • Reduced Formula: AcB4Ru
  • Formula Anonymous: ABC4
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm