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  1. Third-Parties
  2. MatprojStructure
  3. mp-1224957

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-1224957
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 24
  • Number of elements: 4
  • Element list: ['Fe', 'Mo', 'Rh', 'N']
  • Chemical System: Fe-Mo-N-Rh
  • Density: 9.699618382513332
  • Atomic Density: 0.08019156830354027
  • Unit Cell Volume: 299.283334990475
  • Molar Volume: 7.509693210145307
  • Full Formula: Fe6 Mo12 Rh2 N4
  • Reduced Formula: Fe3Mo6RhN2
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -234.68274717
  • Final energy per atom: -9.77844779875
  • 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.