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  1. Third-Parties
  2. MatprojStructure
  3. mp-1194114

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-1194114
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 29
  • Number of elements: 2
  • Element list: ['Mg', 'Al']
  • Chemical System: Al-Mg
  • Density: 2.1926035525666667
  • Atomic Density: 0.051215248102502615
  • Unit Cell Volume: 566.2376162263075
  • Molar Volume: 11.758491822488566
  • Full Formula: Mg13 Al16
  • Reduced Formula: Mg13Al16
  • Formula Anonymous: A13B16
  • Spacegroup Number: 217
  • Spacegroup Symbol: I-43m
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -80.15489019
  • Final energy per atom: -2.763961730689655
  • 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.