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  1. Third-Parties
  2. MatprojStructure
  3. mp-1208605

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-1208605
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 3
  • Element list: ['Tb', 'Al', 'Si']
  • Chemical System: Al-Si-Tb
  • Density: 6.694793490386155
  • Atomic Density: 0.03796218548182255
  • Unit Cell Volume: 1053.6801159446738
  • Molar Volume: 15.863524935579868
  • Full Formula: Tb24 Al14 Si2
  • Reduced Formula: Tb12Al7Si
  • Formula Anonymous: AB7C12
  • Spacegroup Number: 140
  • Spacegroup Symbol: I4/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -189.28511725
  • Final energy per atom: -4.73212793125
  • 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.