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  1. Third-Parties
  2. MatprojStructure
  3. mp-1181854

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-1181854
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 3
  • Element list: ['Hf', 'Pb', 'O']
  • Chemical System: Hf-O-Pb
  • Density: 9.366655865348129
  • Atomic Density: 0.06503211303777598
  • Unit Cell Volume: 615.0807367548509
  • Molar Volume: 9.260256938755544
  • Full Formula: Hf8 Pb8 O24
  • Reduced Formula: HfPbO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 55
  • Spacegroup Symbol: Pbam
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -336.98896804000003
  • Final energy per atom: -8.424724201
  • 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.