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  1. Third-Parties
  2. MatprojStructure
  3. mp-11629

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-11629
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 13
  • Number of elements: 4
  • Element list: ['Tb', 'Al', 'Si', 'Au']
  • Chemical System: Al-Au-Si-Tb
  • Density: 5.064482240715315
  • Atomic Density: 0.05024879002075621
  • Unit Cell Volume: 258.7126972536076
  • Molar Volume: 11.984648302003773
  • Full Formula: Tb2 Al6 Si4 Au1
  • Reduced Formula: Tb2Al6Si4Au
  • Formula Anonymous: AB2C4D6
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -61.83069311
  • Final energy per atom: -4.7562071623076925
  • 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.