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  1. Third-Parties
  2. MatprojStructure
  3. mp-1217877

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-1217877
  • 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: 71
  • Number of elements: 3
  • Element list: ['Tb', 'P', 'Ir']
  • Chemical System: Ir-P-Tb
  • Density: 13.243728445233678
  • Atomic Density: 0.060813572252814516
  • Unit Cell Volume: 1167.5025388220645
  • Molar Volume: 9.90262623442794
  • Full Formula: Tb14 P24 Ir33
  • Reduced Formula: Tb14(P8Ir11)3
  • Formula Anonymous: A14B24C33
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -556.33573497
  • Final energy per atom: -7.835714577042253
  • 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.