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  1. Third-Parties
  2. MatprojStructure
  3. mp-1003635

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-1003635
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 49
  • Number of elements: 3
  • Element list: ['Na', 'Mn', 'O']
  • Chemical System: Mn-Na-O
  • Density: 4.043810453139657
  • Atomic Density: 0.08439072633395744
  • Unit Cell Volume: 580.6325188634288
  • Molar Volume: 7.1360219559773945
  • Full Formula: Na1 Mn16 O32
  • Reduced Formula: NaMn16O32
  • Formula Anonymous: AB16C32
  • Spacegroup Number: 83
  • Spacegroup Symbol: P4/m
  • Crystal System: tetragonal
  • Pointgroup: 4/m

Thermodynamics:

  • Final energy: -396.53067297
  • Final energy per atom: -8.09246271367347
  • 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.