Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-34269
  • 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: 10
  • Number of elements: 3
  • Element list: ['Al', 'Bi', 'O']
  • Chemical System: Al-Bi-O
  • Density: 8.382572401196233
  • Atomic Density: 0.08888753047738523
  • Unit Cell Volume: 112.50171926583336
  • Molar Volume: 6.775011891608523
  • Full Formula: Al2 Bi2 O6
  • Reduced Formula: AlBiO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 161
  • Spacegroup Symbol: R3cH
  • Crystal System: trigonal
  • Pointgroup: 3m