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  1. Third-Parties
  2. MatprojStructure
  3. mp-563025

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-563025
  • 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: 12
  • Number of elements: 3
  • Element list: ['Na', 'Pb', 'O']
  • Chemical System: Na-O-Pb
  • Density: 3.8255662491384568
  • Atomic Density: 0.06502799840035785
  • Unit Cell Volume: 184.53589677048961
  • Molar Volume: 9.260842880205983
  • Full Formula: Na6 Pb1 O5
  • Reduced Formula: Na6PbO5
  • Formula Anonymous: AB5C6
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm

Thermodynamics:

  • Final energy: -54.82351168000001
  • Final energy per atom: -4.568625973333334
  • 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.