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  1. Third-Parties
  2. MatprojStructure
  3. mp-781824

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-781824
  • 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: 45
  • Number of elements: 5
  • Element list: ['Li', 'La', 'Ti', 'Nb', 'O']
  • Chemical System: La-Li-Nb-O-Ti
  • Density: 4.84954317910751
  • Atomic Density: 0.07568050513072824
  • Unit Cell Volume: 594.6049107662316
  • Molar Volume: 7.957321042714414
  • Full Formula: Li5 La4 Ti1 Nb7 O28
  • Reduced Formula: Li5La4TiNb7O28
  • Formula Anonymous: AB4C5D7E28
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -391.1202491300001
  • Final energy per atom: -8.69156109177778
  • 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.