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: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-1592884
  • Created at: Sept. 4, 2022, 3:57 p.m.
  • Last updated at: Sept. 4, 2022, 3:57 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 2
  • Element list: ['Bi', 'Te']
  • Chemical System: Bi-Te
  • Density: 8.424118288103683
  • Atomic Density: 0.03278761412204107
  • Unit Cell Volume: 182.99593186826527
  • Molar Volume: 18.367121003634388
  • Full Formula: Bi2 Te4
  • Reduced Formula: BiTe2
  • Formula Anonymous: AB2
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m