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-111366
  • 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: 8
  • Number of elements: 3
  • Element list: ['In', 'Bi', 'Te']
  • Chemical System: Bi-In-Te
  • Density: 6.981543878931883
  • Atomic Density: 0.03161683057105403
  • Unit Cell Volume: 253.02979000444762
  • Molar Volume: 19.047262648500308
  • Full Formula: In3 Bi1 Te4
  • Reduced Formula: In3BiTe4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 97
  • Spacegroup Symbol: I422
  • Crystal System: tetragonal
  • Pointgroup: 422