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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220861

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-1220861
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 24
  • Number of elements: 4
  • Element list: ['Na', 'La', 'Ga', 'S']
  • Chemical System: Ga-La-Na-S
  • Density: 4.502124736239473
  • Atomic Density: 0.0429645170376678
  • Unit Cell Volume: 558.6004837191292
  • Molar Volume: 14.016544756502851
  • Full Formula: Na1 La6 Ga3 S14
  • Reduced Formula: NaLa6Ga3S14
  • Formula Anonymous: AB3C6D14
  • Spacegroup Number: 143
  • Spacegroup Symbol: P3
  • Crystal System: trigonal
  • Pointgroup: 3

Thermodynamics:

  • Final energy: -144.77511702
  • Final energy per atom: -6.0322965425
  • 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.