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  1. Third-Parties
  2. MatprojStructure
  3. mp-1204606

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-1204606
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 44
  • Number of elements: 3
  • Element list: ['Sm', 'Ga', 'Fe']
  • Chemical System: Fe-Ga-Sm
  • Density: 7.4701730300197235
  • Atomic Density: 0.060359873894311425
  • Unit Cell Volume: 728.9610988426327
  • Molar Volume: 9.977059876805926
  • Full Formula: Sm4 Ga32 Fe8
  • Reduced Formula: Sm(Ga4Fe)2
  • Formula Anonymous: AB2C8
  • Spacegroup Number: 55
  • Spacegroup Symbol: Pbam
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -197.59265844
  • Final energy per atom: -4.490742237272728
  • 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.