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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-95332
  • 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: 36
  • Number of elements: 3
  • Element list: ['Zn', 'Pb', 'F']
  • Chemical System: F-Pb-Zn
  • Density: 7.554876192187101
  • Atomic Density: 0.06895741854659858
  • Unit Cell Volume: 522.0613062200506
  • Molar Volume: 8.733129642796134
  • Full Formula: Zn4 Pb8 F24
  • Reduced Formula: ZnPb2F6
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 138
  • Spacegroup Symbol: P4_2/ncm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm