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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-4255
  • 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: 5
  • Number of elements: 3
  • Element list: ['As', 'Li', 'Pr']
  • Chemical System: As-Li-Pr
  • Density: 4.540162644301618
  • Atomic Density: 0.04487614931667217
  • Unit Cell Volume: 111.41775923591608
  • Molar Volume: 13.419468585649534
  • Full Formula: Li2 Pr1 As2
  • Reduced Formula: Li2PrAs2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1