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  1. Third-Parties
  2. MatprojStructure
  3. mp-1226666

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-1226666
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 6
  • Number of elements: 4
  • Element list: ['Ce', 'Al', 'Cu', 'Ni']
  • Chemical System: Al-Ce-Cu-Ni
  • Density: 7.718584215938087
  • Atomic Density: 0.06776249692652772
  • Unit Cell Volume: 88.54455299227787
  • Molar Volume: 8.887129360846275
  • Full Formula: Ce1 Al1 Cu2 Ni2
  • Reduced Formula: CeAl(CuNi)2
  • Formula Anonymous: ABC2D2
  • Spacegroup Number: 65
  • Spacegroup Symbol: Cmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -31.60912943
  • Final energy per atom: -5.268188238333333
  • 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.