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  1. Third-Parties
  2. MatprojStructure
  3. mp-685982

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-685982
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 70
  • Number of elements: 3
  • Element list: ['Mg', 'In', 'O']
  • Chemical System: In-Mg-O
  • Density: 5.764000476841678
  • Atomic Density: 0.07642398738929564
  • Unit Cell Volume: 915.9427869606891
  • Molar Volume: 7.879909130262803
  • Full Formula: Mg10 In20 O40
  • Reduced Formula: MgIn2O4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -428.19061312
  • Final energy per atom: -6.117008758857144
  • 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.