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  1. Third-Parties
  2. MatprojStructure
  3. mp-1235081

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-1235081
  • 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: 9
  • Number of elements: 5
  • Element list: ['Li', 'Tm', 'U', 'S', 'O']
  • Chemical System: Li-O-S-Tm-U
  • Density: 8.435251643088563
  • Atomic Density: 0.05860386250583109
  • Unit Cell Volume: 153.57349524708374
  • Molar Volume: 10.276013393145883
  • Full Formula: Li1 Tm1 U2 S3 O2
  • Reduced Formula: LiTmU2S3O2
  • Formula Anonymous: ABC2D2E3
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -72.53800987
  • Final energy per atom: -8.059778874444444
  • 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.