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  1. Third-Parties
  2. MatprojStructure
  3. mp-1225232

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-1225232
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 25
  • Number of elements: 3
  • Element list: ['Ga', 'Fe', 'N']
  • Chemical System: Fe-Ga-N
  • Density: 7.517408230880101
  • Atomic Density: 0.09425061829518455
  • Unit Cell Volume: 265.2502493055507
  • Molar Volume: 6.389497351772475
  • Full Formula: Ga1 Fe19 N5
  • Reduced Formula: GaFe19N5
  • Formula Anonymous: AB5C19
  • Spacegroup Number: 83
  • Spacegroup Symbol: P4/m
  • Crystal System: tetragonal
  • Pointgroup: 4/m

Thermodynamics:

  • Final energy: -202.50454694
  • Final energy per atom: -8.1001818776
  • 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.