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  1. Third-Parties
  2. MatprojStructure
  3. mp-1518477

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-1518477
  • 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: 40
  • Number of elements: 5
  • Element list: ['Ba', 'Eu', 'Nb', 'Bi', 'O']
  • Chemical System: Ba-Bi-Eu-Nb-O
  • Density: 7.175880977599178
  • Atomic Density: 0.06288677106442292
  • Unit Cell Volume: 636.0638226921034
  • Molar Volume: 9.576164681488821
  • Full Formula: Ba4 Eu4 Nb4 Bi4 O24
  • Reduced Formula: BaEuNbBiO6
  • Formula Anonymous: ABCDE6
  • Spacegroup Number: 16
  • Spacegroup Symbol: P222
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -335.81402338
  • Final energy per atom: -8.3953505845
  • 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.