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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-46018
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 58
  • Number of elements: 2
  • Element list: ['Pr', 'Se']
  • Chemical System: Pr-Se
  • Density: 6.431475331991933
  • Atomic Density: 0.03860722073229666
  • Unit Cell Volume: 1502.3096431150357
  • Molar Volume: 15.598482993007087
  • Full Formula: Pr20 Se38
  • Reduced Formula: Pr10Se19
  • Formula Anonymous: A10B19
  • Spacegroup Number: 86
  • Spacegroup Symbol: P4_2/n
  • Crystal System: tetragonal
  • Pointgroup: 4/m