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  1. Third-Parties
  2. MatprojStructure
  3. mp-1173546

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-1173546
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 3
  • Element list: ['Nb', 'Pb', 'O']
  • Chemical System: Nb-O-Pb
  • Density: 6.461796776840477
  • Atomic Density: 0.06479066886574977
  • Unit Cell Volume: 617.3728516815045
  • Molar Volume: 9.294765535571557
  • Full Formula: Nb8 Pb6 O26
  • Reduced Formula: Nb4Pb3O13
  • Formula Anonymous: A3B4C13
  • Spacegroup Number: 51
  • Spacegroup Symbol: Pmma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -337.50644276
  • Final energy per atom: -8.437661069
  • 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.