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  1. Third-Parties
  2. MatprojStructure
  3. mp-8424

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-8424
  • 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: 15
  • Number of elements: 3
  • Element list: ['Li', 'Pr', 'O']
  • Chemical System: Li-O-Pr
  • Density: 3.0445544964887277
  • Atomic Density: 0.09404613346424649
  • Unit Cell Volume: 159.49619030007807
  • Molar Volume: 6.403390057805446
  • Full Formula: Li8 Pr1 O6
  • Reduced Formula: Li8PrO6
  • Formula Anonymous: AB6C8
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -82.95129505
  • Final energy per atom: -5.530086336666667
  • 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.