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  1. Third-Parties
  2. MatprojStructure
  3. mp-1223959

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-1223959
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['La', 'In', 'Ni']
  • Chemical System: In-La-Ni
  • Density: 8.204201873474418
  • Atomic Density: 0.0544306566309702
  • Unit Cell Volume: 330.69599218757685
  • Molar Volume: 11.063876742896934
  • Full Formula: La3 In6 Ni9
  • Reduced Formula: LaIn2Ni3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m

Thermodynamics:

  • Final energy: -88.97570257
  • Final energy per atom: -4.943094587222222
  • 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.