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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-1783
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Pr', 'Cu', 'O']
  • Chemical System: Cu-O-Pr
  • Density: 5.496074208137614
  • Atomic Density: 0.05599118557705494
  • Unit Cell Volume: 71.43981608489446
  • Molar Volume: 10.755515708293663
  • Full Formula: Pr1 Cu1 O2
  • Reduced Formula: PrCuO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m