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  1. Third-Parties
  2. MatprojStructure
  3. mp-601848

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-601848
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 16
  • Number of elements: 2
  • Element list: ['Fe', 'Co']
  • Chemical System: Co-Fe
  • Density: 8.108531663798573
  • Atomic Density: 0.08595435077407912
  • Unit Cell Volume: 186.14531848485615
  • Molar Volume: 7.0062081858177105
  • Full Formula: Fe11 Co5
  • Reduced Formula: Fe11Co5
  • Formula Anonymous: A5B11
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -129.62424892
  • Final energy per atom: -8.1015155575
  • 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.