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  1. Third-Parties
  2. MatprojStructure
  3. mp-1173875

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-1173875
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 100
  • Number of elements: 5
  • Element list: ['Na', 'Ca', 'La', 'Mn', 'O']
  • Chemical System: Ca-La-Mn-Na-O
  • Density: 5.84330785445722
  • Atomic Density: 0.08359094656206716
  • Unit Cell Volume: 1196.3018019630745
  • Molar Volume: 7.204297842863279
  • Full Formula: Na2 Ca4 La14 Mn20 O60
  • Reduced Formula: NaCa2La7Mn10O30
  • Formula Anonymous: AB2C7D10E30
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -837.0670056499999
  • Final energy per atom: -8.3706700565
  • 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.