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  1. Third-Parties
  2. MatprojStructure
  3. mp-26074

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-26074
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 34
  • Number of elements: 3
  • Element list: ['Bi', 'P', 'O']
  • Chemical System: Bi-O-P
  • Density: 4.383554976677622
  • Atomic Density: 0.06384814079612113
  • Unit Cell Volume: 532.5135481793943
  • Molar Volume: 9.431975128656925
  • Full Formula: Bi4 P6 O24
  • Reduced Formula: Bi2(PO4)3
  • Formula Anonymous: A2B3C12
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -240.2831477
  • Final energy per atom: -7.067151402941176
  • 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.