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  1. Third-Parties
  2. MatprojStructure
  3. mp-1219362

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-1219362
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 42
  • Number of elements: 4
  • Element list: ['Sm', 'Cr', 'Fe', 'C']
  • Chemical System: C-Cr-Fe-Sm
  • Density: 7.888198456701895
  • Atomic Density: 0.07865289568660909
  • Unit Cell Volume: 533.9917829261897
  • Molar Volume: 7.656604003487807
  • Full Formula: Sm4 Cr3 Fe31 C4
  • Reduced Formula: Sm4Cr3Fe31C4
  • Formula Anonymous: A3B4C4D31
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -348.17635445
  • Final energy per atom: -8.289913201190476
  • 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.