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  1. Third-Parties
  2. MatprojStructure
  3. mp-1225245

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-1225245
  • 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: 24
  • Number of elements: 4
  • Element list: ['Fe', 'Mo', 'Rh', 'N']
  • Chemical System: Fe-Mo-N-Rh
  • Density: 10.221628760490832
  • Atomic Density: 0.07629226182750865
  • Unit Cell Volume: 314.5797414456303
  • Molar Volume: 7.8935145134583
  • Full Formula: Fe2 Mo12 Rh6 N4
  • Reduced Formula: FeMo6Rh3N2
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -231.09860134
  • Final energy per atom: -9.629108389166666
  • 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.