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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-61358
  • 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: 18
  • Number of elements: 3
  • Element list: ['B', 'As', 'O']
  • Chemical System: As-B-O
  • Density: 3.926632981368789
  • Atomic Density: 0.09475738308570929
  • Unit Cell Volume: 189.9588128528071
  • Molar Volume: 6.3553261644561205
  • Full Formula: B3 As3 O12
  • Reduced Formula: BAsO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 152
  • Spacegroup Symbol: P3_121
  • Crystal System: trigonal
  • Pointgroup: 321