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  1. Third-Parties
  2. MatprojStructure
  3. mp-1222018

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-1222018
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 14
  • Number of elements: 4
  • Element list: ['Mn', 'Cr', 'Fe', 'O']
  • Chemical System: Cr-Fe-Mn-O
  • Density: 4.666920621074745
  • Atomic Density: 0.08749475754250059
  • Unit Cell Volume: 160.00958678237947
  • Molar Volume: 6.882858961092319
  • Full Formula: Mn2 Cr3 Fe1 O8
  • Reduced Formula: Mn2Cr3FeO8
  • Formula Anonymous: AB2C3D8
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -126.31382229
  • Final energy per atom: -9.022415877857144
  • 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.