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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117856
  • 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: 4
  • Number of elements: 3
  • Element list: ['Pb', 'Se', 'Br']
  • Chemical System: Br-Pb-Se
  • Density: 6.009069590651848
  • Atomic Density: 0.03245745248452501
  • Unit Cell Volume: 123.23826097895733
  • Molar Volume: 18.55395386582241
  • Full Formula: Pb1 Se1 Br2
  • Reduced Formula: PbSeBr2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm