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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-5215
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 20
  • Number of elements: 2
  • Element list: ['Bi', 'Se']
  • Chemical System: Bi-Se
  • Density: 7.502287104750455
  • Atomic Density: 0.034496803637123166
  • Unit Cell Volume: 579.7638590051088
  • Molar Volume: 17.457097832447793
  • Full Formula: Bi8 Se12
  • Reduced Formula: Bi2Se3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm