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  1. Third-Parties
  2. MatprojStructure
  3. mp-639263

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-639263
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Ce', 'Mn', 'Bi']
  • Chemical System: Bi-Ce-Mn
  • Density: 10.235647715987724
  • Atomic Density: 0.0364931564785967
  • Unit Cell Volume: 493.2431649357882
  • Molar Volume: 16.50210982306229
  • Full Formula: Ce6 Mn2 Bi10
  • Reduced Formula: Ce3MnBi5
  • Formula Anonymous: AB3C5
  • Spacegroup Number: 193
  • Spacegroup Symbol: P6_3/mcm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm

Thermodynamics:

  • Final energy: -101.83382571
  • Final energy per atom: -5.657434761666667
  • 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.