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  1. Third-Parties
  2. MatprojStructure
  3. mp-601286

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-601286
  • 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: 24
  • Number of elements: 4
  • Element list: ['Tb', 'Cu', 'Pb', 'Se']
  • Chemical System: Cu-Pb-Se-Tb
  • Density: 7.468477472242877
  • Atomic Density: 0.04048560335189038
  • Unit Cell Volume: 592.8033180436565
  • Molar Volume: 14.87477093439145
  • Full Formula: Tb4 Cu4 Pb4 Se12
  • Reduced Formula: TbCuPbSe3
  • Formula Anonymous: ABCD3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -121.54498636
  • Final energy per atom: -5.064374431666667
  • 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.