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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91487
  • 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: 46
  • Number of elements: 5
  • Element list: ['Li', 'Be', 'As', 'Cl', 'O']
  • Chemical System: As-Be-Cl-Li-O
  • Density: 2.966566275520509
  • Atomic Density: 0.08104295855030896
  • Unit Cell Volume: 567.6002063947927
  • Molar Volume: 7.430800735466291
  • Full Formula: Li8 Be6 As6 Cl2 O24
  • Reduced Formula: Li4Be3As3ClO12
  • Formula Anonymous: AB3C3D4E12
  • Spacegroup Number: 218
  • Spacegroup Symbol: P-43n
  • Crystal System: cubic
  • Pointgroup: -43m