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  1. Third-Parties
  2. MatprojStructure
  3. mp-1223301

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-1223301
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['La', 'Al', 'Cu']
  • Chemical System: Al-Cu-La
  • Density: 6.660246070912814
  • Atomic Density: 0.05989555939133366
  • Unit Cell Volume: 200.34874241004735
  • Molar Volume: 10.054402732352392
  • Full Formula: La2 Al3 Cu7
  • Reduced Formula: La2Al3Cu7
  • Formula Anonymous: A2B3C7
  • Spacegroup Number: 10
  • Spacegroup Symbol: P12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -53.79787816
  • Final energy per atom: -4.483156513333333
  • 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.