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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-3222
  • 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: 8
  • Number of elements: 4
  • Element list: ['Pr', 'Zn', 'P', 'O']
  • Chemical System: O-P-Pr-Zn
  • Density: 5.726671676350508
  • Atomic Density: 0.05446223464085611
  • Unit Cell Volume: 146.89077766924044
  • Molar Volume: 11.05746174337538
  • Full Formula: Pr2 Zn2 P2 O2
  • Reduced Formula: PrZnPO
  • Formula Anonymous: ABCD
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m