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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-118428
  • 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: 6
  • Number of elements: 3
  • Element list: ['H', 'Pb', 'I']
  • Chemical System: H-I-Pb
  • Density: 7.700638883285637
  • Atomic Density: 0.0511173115545047
  • Unit Cell Volume: 117.37706498125196
  • Molar Volume: 11.781020121879433
  • Full Formula: H3 Pb2 I1
  • Reduced Formula: H3Pb2I
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1