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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1731844
  • 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: 18
  • Number of elements: 4
  • Element list: ['Cr', 'O', 'Pr', 'Se']
  • Chemical System: Cr-O-Pr-Se
  • Density: 5.512056223125632
  • Atomic Density: 0.08121276691087909
  • Unit Cell Volume: 221.64002883626367
  • Molar Volume: 7.415263620569105
  • Full Formula: Pr2 Cr2 Se2 O12
  • Reduced Formula: PrCrSeO6
  • Formula Anonymous: ABCD6
  • Spacegroup Number: 163
  • Spacegroup Symbol: P-31c
  • Crystal System: trigonal
  • Pointgroup: -31m