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  1. Third-Parties
  2. MatprojStructure
  3. mp-1211171

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-1211171
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 24
  • Number of elements: 4
  • Element list: ['Li', 'Er', 'S', 'O']
  • Chemical System: Er-Li-O-S
  • Density: 3.667228179109015
  • Atomic Density: 0.07234412800844146
  • Unit Cell Volume: 331.74772660470194
  • Molar Volume: 8.324297943431299
  • Full Formula: Li2 Er2 S4 O16
  • Reduced Formula: LiEr(SO4)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 118
  • Spacegroup Symbol: P-4n2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -166.19485903
  • Final energy per atom: -6.9247857929166665
  • 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.