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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1710690
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Be', 'C', 'O']
  • Chemical System: Be-C-O
  • Density: 3.240973703895167
  • Atomic Density: 0.14138868361307436
  • Unit Cell Volume: 70.72701820582824
  • Molar Volume: 4.259280591705803
  • Full Formula: Be2 C2 O6
  • Reduced Formula: BeCO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m