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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-85682
  • 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: 16
  • Number of elements: 4
  • Element list: ['H', 'Pb', 'Br', 'O']
  • Chemical System: Br-H-O-Pb
  • Density: 6.583791054546422
  • Atomic Density: 0.05215000069199533
  • Unit Cell Volume: 306.80728260193274
  • Molar Volume: 11.547729012637113
  • Full Formula: H4 Pb4 Br4 O4
  • Reduced Formula: HPbBrO
  • Formula Anonymous: ABCD
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm