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  1. Third-Parties
  2. MatprojStructure
  3. mp-1190404

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-1190404
  • 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: 22
  • Number of elements: 4
  • Element list: ['Sr', 'Li', 'Nb', 'O']
  • Chemical System: Li-Nb-O-Sr
  • Density: 4.746216644776646
  • Atomic Density: 0.06854232418663539
  • Unit Cell Volume: 320.9695653169817
  • Molar Volume: 8.786017736431264
  • Full Formula: Sr6 Li2 Nb2 O12
  • Reduced Formula: Sr3LiNbO6
  • Formula Anonymous: ABC3D6
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -161.77008819
  • Final energy per atom: -7.353185826818182
  • 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.