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  1. Third-Parties
  2. MatprojStructure
  3. mp-1235167

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-1235167
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 21
  • Number of elements: 4
  • Element list: ['Li', 'Y', 'Bi', 'O']
  • Chemical System: Bi-Li-O-Y
  • Density: 6.865562720847883
  • Atomic Density: 0.06244274184063037
  • Unit Cell Volume: 336.30810212654177
  • Molar Volume: 9.644260617783285
  • Full Formula: Li1 Y4 Bi4 O12
  • Reduced Formula: LiY4(BiO3)4
  • Formula Anonymous: AB4C4D12
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -156.56227432
  • Final energy per atom: -7.4553463961904765
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.