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  1. Third-Parties
  2. MatprojStructure
  3. mp-1222974

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-1222974
  • 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: 8
  • Number of elements: 4
  • Element list: ['La', 'Al', 'Cu', 'Si']
  • Chemical System: Al-Cu-La-Si
  • Density: 4.678379612014203
  • Atomic Density: 0.05606611164171875
  • Unit Cell Volume: 142.6886895799495
  • Molar Volume: 10.741142168880014
  • Full Formula: La1 Al4 Cu2 Si1
  • Reduced Formula: LaAl4Cu2Si
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -36.163751430000005
  • Final energy per atom: -4.520468928750001
  • 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.