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  1. Third-Parties
  2. MatprojStructure
  3. mp-1003314

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-1003314
  • 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: 7
  • Number of elements: 3
  • Element list: ['K', 'Mn', 'O']
  • Chemical System: K-Mn-O
  • Density: 3.5469974939700717
  • Atomic Density: 0.07020811860754897
  • Unit Cell Volume: 99.7035690292282
  • Molar Volume: 8.577556099548412
  • Full Formula: K1 Mn2 O4
  • Reduced Formula: KMn2O4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -53.00058505
  • Final energy per atom: -7.571512149999999
  • 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.