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  1. Third-Parties
  2. MatprojStructure
  3. mp-1235405

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-1235405
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 17
  • Number of elements: 4
  • Element list: ['Li', 'Sm', 'H', 'O']
  • Chemical System: H-Li-O-Sm
  • Density: 5.705699673482458
  • Atomic Density: 0.07889285142988176
  • Unit Cell Volume: 215.48213420970376
  • Molar Volume: 7.633316138094395
  • Full Formula: Li1 Sm4 H4 O8
  • Reduced Formula: LiSm4(HO2)4
  • Formula Anonymous: AB4C4D8
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -118.61640664
  • Final energy per atom: -6.977435684705882
  • 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.