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  1. Third-Parties
  2. MatprojStructure
  3. mp-9510

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-9510
  • 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: 16
  • Number of elements: 4
  • Element list: ['Tl', 'P', 'Au', 'S']
  • Chemical System: Au-P-S-Tl
  • Density: 5.870987142438443
  • Atomic Density: 0.03697510002207687
  • Unit Cell Volume: 432.72364349107414
  • Molar Volume: 16.287016820520662
  • Full Formula: Tl4 P2 Au2 S8
  • Reduced Formula: Tl2PAuS4
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -69.62846975000001
  • Final energy per atom: -4.3517793593750005
  • 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.