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  1. Third-Parties
  2. MatprojStructure
  3. mp-1178893

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-1178893
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 23
  • Number of elements: 4
  • Element list: ['U', 'Bi', 'As', 'O']
  • Chemical System: As-Bi-O-U
  • Density: 6.530431766529737
  • Atomic Density: 0.06112547895312835
  • Unit Cell Volume: 376.2751702548889
  • Molar Volume: 9.852095825077852
  • Full Formula: U1 Bi4 As2 O16
  • Reduced Formula: UBi4(AsO8)2
  • Formula Anonymous: AB2C4D16
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -157.99867632
  • Final energy per atom: -6.869507666086956
  • 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.