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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-4653
  • 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: ['As', 'O', 'Y']
  • Chemical System: As-O-Y
  • Density: 4.846249346056569
  • Atomic Density: 0.07686107141448122
  • Unit Cell Volume: 156.12584861442755
  • Molar Volume: 7.83509863858778
  • Full Formula: Y2 As2 O8
  • Reduced Formula: YAsO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 141
  • Spacegroup Symbol: I4_1/amd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm