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-58958
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 28
  • Number of elements: 3
  • Element list: ['Rb', 'Bi', 'Se']
  • Chemical System: Bi-Rb-Se
  • Density: 4.4985979228326185
  • Atomic Density: 0.02700385944186878
  • Unit Cell Volume: 1036.8888217728882
  • Molar Volume: 22.30103727566745
  • Full Formula: Rb12 Bi4 Se12
  • Reduced Formula: Rb3BiSe3
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 198
  • Spacegroup Symbol: P2_13
  • Crystal System: cubic
  • Pointgroup: 23