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  1. Third-Parties
  2. MatprojStructure
  3. mp-1228967

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-1228967
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 4
  • Element list: ['Al', 'Cr', 'Ga', 'C']
  • Chemical System: Al-C-Cr-Ga
  • Density: 6.131138957374102
  • Atomic Density: 0.08986046983600689
  • Unit Cell Volume: 89.02691043792449
  • Molar Volume: 6.701657326063682
  • Full Formula: Al1 Cr4 Ga1 C2
  • Reduced Formula: AlCr4GaC2
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2

Thermodynamics:

  • Final energy: -65.05104968
  • Final energy per atom: -8.13138121
  • 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.