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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1207080
  • Created at: Sept. 4, 2022, 3:38 p.m.
  • Last updated at: Sept. 4, 2022, 3:38 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Ac', 'B', 'Ru']
  • Chemical System: Ac-B-Ru
  • Density: 8.784543568122832
  • Atomic Density: 0.058680365578586996
  • Unit Cell Volume: 85.20737644866593
  • Molar Volume: 10.262616295283504
  • Full Formula: Ac1 B2 Ru2
  • Reduced Formula: Ac(BRu)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm