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  1. Third-Parties
  2. MatprojStructure
  3. mp-1204440

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-1204440
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 102
  • Number of elements: 3
  • Element list: ['In', 'Mo', 'O']
  • Chemical System: In-Mo-O
  • Density: 6.0031389050895525
  • Atomic Density: 0.06706961379677173
  • Unit Cell Volume: 1520.8079221847192
  • Molar Volume: 8.978940565019123
  • Full Formula: In10 Mo36 O56
  • Reduced Formula: In5(Mo9O14)2
  • Formula Anonymous: A5B18C28
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -808.36187248
  • Final energy per atom: -7.925116396862745
  • 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.