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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-3467
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['B', 'Ni', 'Y']
  • Chemical System: B-Ni-Y
  • Density: 7.384169826998781
  • Atomic Density: 0.07976642103109169
  • Unit Cell Volume: 150.43924304091053
  • Molar Volume: 7.549719145168447
  • Full Formula: Y2 Ni8 B2
  • Reduced Formula: YNi4B
  • Formula Anonymous: ABC4
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm