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  1. Third-Parties
  2. MatprojStructure
  3. mp-560314

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-560314
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 64
  • Number of elements: 4
  • Element list: ['In', 'H', 'S', 'O']
  • Chemical System: H-In-O-S
  • Density: 2.7869587113661343
  • Atomic Density: 0.0883484896130257
  • Unit Cell Volume: 724.4040082668729
  • Molar Volume: 6.816348288892676
  • Full Formula: In4 H20 S6 O34
  • Reduced Formula: In2H10S3O17
  • Formula Anonymous: A2B3C10D17
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -376.3387604
  • Final energy per atom: -5.88029313125
  • 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.