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  1. Third-Parties
  2. MatprojStructure
  3. mp-1208190

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-1208190
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 48
  • Number of elements: 4
  • Element list: ['Tl', 'Bi', 'Mo', 'O']
  • Chemical System: Bi-Mo-O-Tl
  • Density: 6.310362085194146
  • Atomic Density: 0.06219291759355196
  • Unit Cell Volume: 771.7920602100286
  • Molar Volume: 9.68300088340664
  • Full Formula: Tl4 Bi4 Mo8 O32
  • Reduced Formula: TlBi(MoO4)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -358.81356754
  • Final energy per atom: -7.4752826570833335
  • 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.