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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-86763
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 11
  • Number of elements: 3
  • Element list: ['Ba', 'Al', 'Pb']
  • Chemical System: Al-Ba-Pb
  • Density: 4.722684609228997
  • Atomic Density: 0.030410654533669892
  • Unit Cell Volume: 361.71533196765245
  • Molar Volume: 19.80273312872119
  • Full Formula: Ba5 Al5 Pb1
  • Reduced Formula: Ba5Al5Pb
  • Formula Anonymous: AB5C5
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2