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  1. Third-Parties
  2. MatprojStructure
  3. mp-18979

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-18979
  • 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: 60
  • Number of elements: 4
  • Element list: ['Tb', 'Fe', 'B', 'O']
  • Chemical System: B-Fe-O-Tb
  • Density: 4.55607735448747
  • Atomic Density: 0.09769442181308456
  • Unit Cell Volume: 614.1599375529953
  • Molar Volume: 6.16426265516158
  • Full Formula: Tb3 Fe9 B12 O36
  • Reduced Formula: TbFe3(BO3)4
  • Formula Anonymous: AB3C4D12
  • Spacegroup Number: 152
  • Spacegroup Symbol: P3_121
  • Crystal System: trigonal
  • Pointgroup: 321

Thermodynamics:

  • Final energy: -503.2100971699999
  • Final energy per atom: -8.386834952833333
  • 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.