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  1. Third-Parties
  2. MatprojStructure
  3. mp-707290

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-707290
  • 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: 126
  • Number of elements: 3
  • Element list: ['Nb', 'Pb', 'O']
  • Chemical System: Nb-O-Pb
  • Density: 7.096553626273506
  • Atomic Density: 0.06045111150309308
  • Unit Cell Volume: 2084.328920793342
  • Molar Volume: 9.962001707266984
  • Full Formula: Nb20 Pb28 O78
  • Reduced Formula: Nb10Pb14O39
  • Formula Anonymous: A10B14C39
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -983.72723354
  • Final energy per atom: -7.8073589963492065
  • 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.