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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-63666
  • 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: 30
  • Number of elements: 3
  • Element list: ['Al', 'B', 'O']
  • Chemical System: Al-B-O
  • Density: 2.8630455335134957
  • Atomic Density: 0.08926927221319761
  • Unit Cell Volume: 336.0618862037142
  • Molar Volume: 6.746039942632898
  • Full Formula: Al10 B2 O18
  • Reduced Formula: Al5BO9
  • Formula Anonymous: AB5C9
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2