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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-88423
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 20
  • Number of elements: 3
  • Element list: ['Pb', 'O', 'F']
  • Chemical System: F-O-Pb
  • Density: 7.964289164932275
  • Atomic Density: 0.051198184107602636
  • Unit Cell Volume: 390.6388546509038
  • Molar Volume: 11.762410845164618
  • Full Formula: Pb8 O4 F8
  • Reduced Formula: Pb2OF2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 137
  • Spacegroup Symbol: P4_2/nmc
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm