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  1. Third-Parties
  2. MatprojStructure
  3. mp-1234341

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-1234341
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 37
  • Number of elements: 5
  • Element list: ['Mg', 'Ta', 'Mn', 'Nb', 'O']
  • Chemical System: Mg-Mn-Nb-O-Ta
  • Density: 6.33127675987198
  • Atomic Density: 0.08185453807160716
  • Unit Cell Volume: 452.02136462650407
  • Molar Volume: 7.357125092724574
  • Full Formula: Mg1 Ta4 Mn4 Nb4 O24
  • Reduced Formula: MgTa4Mn4Nb4O24
  • Formula Anonymous: AB4C4D4E24
  • Spacegroup Number: 3
  • Spacegroup Symbol: P121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -352.1533824
  • Final energy per atom: -9.517658983783784
  • 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.