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  1. Third-Parties
  2. MatprojStructure
  3. mp-1217002

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-1217002
  • 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: 13
  • Number of elements: 4
  • Element list: ['U', 'Al', 'Fe', 'Si']
  • Chemical System: Al-Fe-Si-U
  • Density: 7.701148901156791
  • Atomic Density: 0.07870226985729929
  • Unit Cell Volume: 165.17947987486548
  • Molar Volume: 7.651800603615594
  • Full Formula: U1 Al3 Fe7 Si2
  • Reduced Formula: UAl3Fe7Si2
  • Formula Anonymous: AB2C3D7
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -95.19451909
  • Final energy per atom: -7.3226553146153845
  • 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.