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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112874
  • 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: 14
  • Number of elements: 3
  • Element list: ['Bi', 'Pt', 'Se']
  • Chemical System: Bi-Pt-Se
  • Density: 11.854030507678118
  • Atomic Density: 0.04303611802256305
  • Unit Cell Volume: 325.30815146152486
  • Molar Volume: 13.99322484626216
  • Full Formula: Bi4 Pt6 Se4
  • Reduced Formula: Bi2Pt3Se2
  • Formula Anonymous: A2B2C3
  • Spacegroup Number: 199
  • Spacegroup Symbol: I2_13
  • Crystal System: cubic
  • Pointgroup: 23