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  1. Third-Parties
  2. MatprojStructure
  3. mp-973966

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-973966
  • 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: 18
  • Number of elements: 4
  • Element list: ['Li', 'In', 'I', 'O']
  • Chemical System: I-In-Li-O
  • Density: 4.799462593368732
  • Atomic Density: 0.06333989681150266
  • Unit Cell Volume: 284.1810755323359
  • Molar Volume: 9.50765798991066
  • Full Formula: Li1 In1 I4 O12
  • Reduced Formula: LiIn(IO3)4
  • Formula Anonymous: ABC4D12
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -90.79826796
  • Final energy per atom: -5.04434822
  • 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.