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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-684579
  • 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: 82
  • Number of elements: 5
  • Element list: ['As', 'Cu', 'H', 'O', 'U']
  • Chemical System: As-Cu-H-O-U
  • Density: 4.050492325110355
  • Atomic Density: 0.09751706614802973
  • Unit Cell Volume: 840.8784558338228
  • Molar Volume: 6.1754736866862485
  • Full Formula: U4 Cu2 As4 H32 O40
  • Reduced Formula: U2CuAs2(H4O5)4
  • Formula Anonymous: AB2C2D16E20
  • Spacegroup Number: 85
  • Spacegroup Symbol: P4/n1
  • Crystal System: tetragonal
  • Pointgroup: 4/m