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  1. Third-Parties
  2. MatprojStructure
  3. mp-768522

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-768522
  • 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: 44
  • Number of elements: 3
  • Element list: ['La', 'Ce', 'O']
  • Chemical System: Ce-La-O
  • Density: 6.051411740064154
  • Atomic Density: 0.05982743421488473
  • Unit Cell Volume: 735.448554286372
  • Molar Volume: 10.065851626479622
  • Full Formula: La8 Ce8 O28
  • Reduced Formula: La2Ce2O7
  • Formula Anonymous: A2B2C7
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -393.28535614
  • Final energy per atom: -8.938303548636362
  • 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.