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  1. Third-Parties
  2. MatprojStructure
  3. mp-1203554

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-1203554
  • 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: 46
  • Number of elements: 2
  • Element list: ['Al', 'Si']
  • Chemical System: Al-Si
  • Density: 1.8943544391017222
  • Atomic Density: 0.040898655027154396
  • Unit Cell Volume: 1124.7313626684936
  • Molar Volume: 14.724544746035386
  • Full Formula: Al8 Si38
  • Reduced Formula: Al4Si19
  • Formula Anonymous: A4B19
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -222.7448797
  • Final energy per atom: -4.842279993478261
  • 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.