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  1. Third-Parties
  2. MatprojStructure
  3. mp-743694

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-743694
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 30
  • Number of elements: 5
  • Element list: ['Ba', 'La', 'Mn', 'Sn', 'O']
  • Chemical System: Ba-La-Mn-O-Sn
  • Density: 6.523451324300687
  • Atomic Density: 0.07796396861047873
  • Unit Cell Volume: 384.7931362997324
  • Molar Volume: 7.724261434262846
  • Full Formula: Ba2 La4 Mn5 Sn1 O18
  • Reduced Formula: Ba2La4Mn5SnO18
  • Formula Anonymous: AB2C4D5E18
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -246.94124849
  • Final energy per atom: -8.231374949666666
  • 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.