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  1. Third-Parties
  2. MatprojStructure
  3. mp-1188684

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-1188684
  • 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: 17
  • Number of elements: 3
  • Element list: ['Tb', 'Ru', 'Br']
  • Chemical System: Br-Ru-Tb
  • Density: 5.4952144945843955
  • Atomic Density: 0.03034966504799699
  • Unit Cell Volume: 560.1379775729011
  • Molar Volume: 19.842527917445494
  • Full Formula: Tb6 Ru1 Br10
  • Reduced Formula: Tb6RuBr10
  • Formula Anonymous: AB6C10
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -85.51157714
  • Final energy per atom: -5.030092772941177
  • 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.