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  1. Third-Parties
  2. MatprojStructure
  3. mp-504583

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-504583
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 4
  • Element list: ['Fe', 'Co', 'B', 'O']
  • Chemical System: B-Co-Fe-O
  • Density: 4.47866279789023
  • Atomic Density: 0.0995839212132561
  • Unit Cell Volume: 281.1698882597604
  • Molar Volume: 6.047302302049103
  • Full Formula: Fe4 Co4 B4 O16
  • Reduced Formula: FeCoBO4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -223.86741336
  • Final energy per atom: -7.9952647628571425
  • 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.