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  1. Third-Parties
  2. MatprojStructure
  3. mp-1217219

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-1217219
  • 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: 21
  • Number of elements: 4
  • Element list: ['Ti', 'Sb', 'Pb', 'O']
  • Chemical System: O-Pb-Sb-Ti
  • Density: 7.745897310483827
  • Atomic Density: 0.07118834836937475
  • Unit Cell Volume: 294.9920946478119
  • Molar Volume: 8.459447224077934
  • Full Formula: Ti2 Sb2 Pb4 O13
  • Reduced Formula: Ti2Sb2Pb4O13
  • Formula Anonymous: A2B2C4D13
  • Spacegroup Number: 44
  • Spacegroup Symbol: Imm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -150.77434041
  • Final energy per atom: -7.179730495714286
  • 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.