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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-118429
  • 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: 7.257406659036524
  • Atomic Density: 0.039125788688383255
  • Unit Cell Volume: 153.35154130149064
  • Molar Volume: 15.391742791342171
  • Full Formula: H2 Pb2 I2
  • Reduced Formula: HPbI
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm