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  1. Third-Parties
  2. MatprojStructure
  3. mp-559323

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-559323
  • 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: ['Mn', 'Bi', 'N', 'O']
  • Chemical System: Bi-Mn-N-O
  • Density: 6.25341907157125
  • Atomic Density: 0.0786920438698884
  • Unit Cell Volume: 292.27859474623426
  • Molar Volume: 7.6527949508557365
  • Full Formula: Mn4 Bi3 N1 O15
  • Reduced Formula: Mn4Bi3NO15
  • Formula Anonymous: AB3C4D15
  • Spacegroup Number: 143
  • Spacegroup Symbol: P3
  • Crystal System: trigonal
  • Pointgroup: 3

Thermodynamics:

  • Final energy: -168.76427074
  • Final energy per atom: -7.337576988695652
  • 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.