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  1. Third-Parties
  2. MatprojStructure
  3. mp-1180520

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-1180520
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 2
  • Element list: ['Li', 'S']
  • Chemical System: Li-S
  • Density: 1.6240246980206432
  • Atomic Density: 0.05014667144837514
  • Unit Cell Volume: 159.53202413914588
  • Molar Volume: 12.009053813670679
  • Full Formula: Li4 S4
  • Reduced Formula: LiS
  • Formula Anonymous: AB
  • Spacegroup Number: 121
  • Spacegroup Symbol: I-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m

Thermodynamics:

  • Final energy: -31.9713285
  • Final energy per atom: -3.9964160625
  • 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.