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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29946
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 2
  • Element list: ['Pb', 'I']
  • Chemical System: I-Pb
  • Density: 5.962205806969824
  • Atomic Density: 0.023365214537099707
  • Unit Cell Volume: 385.18798899576285
  • Molar Volume: 25.773958764375717
  • Full Formula: Pb3 I6
  • Reduced Formula: PbI2
  • Formula Anonymous: AB2
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m