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  1. Third-Parties
  2. MatprojStructure
  3. mp-1101192

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-1101192
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 4
  • Element list: ['V', 'Cr', 'Fe', 'O']
  • Chemical System: Cr-Fe-O-V
  • Density: 3.353602836084824
  • Atomic Density: 0.07218540553767208
  • Unit Cell Volume: 249.3578842693648
  • Molar Volume: 8.342601548255024
  • Full Formula: V4 Cr1 Fe1 O12
  • Reduced Formula: V4CrFeO12
  • Formula Anonymous: ABC4D12
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -154.24341894
  • Final energy per atom: -8.56907883
  • 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.