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  1. Third-Parties
  2. MatprojStructure
  3. mp-706292

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-706292
  • 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: 80
  • Number of elements: 5
  • Element list: ['Na', 'Mn', 'V', 'Pb', 'O']
  • Chemical System: Mn-Na-O-Pb-V
  • Density: 5.304759451347772
  • Atomic Density: 0.07162114381977601
  • Unit Cell Volume: 1116.9885837247746
  • Molar Volume: 8.408328098129548
  • Full Formula: Na4 Mn8 V12 Pb8 O48
  • Reduced Formula: NaMn2V3(PbO6)2
  • Formula Anonymous: AB2C2D3E12
  • Spacegroup Number: 142
  • Spacegroup Symbol: I4_1/acd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -632.9050770800001
  • Final energy per atom: -7.911313463500001
  • 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.