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  1. Third-Parties
  2. MatprojStructure
  3. mp-1214947

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-1214947
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 70
  • Number of elements: 4
  • Element list: ['Bi', 'As', 'Pb', 'O']
  • Chemical System: As-Bi-O-Pb
  • Density: 7.648535664080373
  • Atomic Density: 0.05705356616744854
  • Unit Cell Volume: 1226.9171710415876
  • Molar Volume: 10.555239864104909
  • Full Formula: Bi17 As5 Pb5 O43
  • Reduced Formula: Bi17As5Pb5O43
  • Formula Anonymous: A5B5C17D43
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -437.99074397
  • Final energy per atom: -6.257010628142857
  • 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.