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  1. Third-Parties
  2. MatprojStructure
  3. mp-1224365

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-1224365
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 48
  • Number of elements: 3
  • Element list: ['K', 'In', 'S']
  • Chemical System: In-K-S
  • Density: 4.283831563707916
  • Atomic Density: 0.03754650720826247
  • Unit Cell Volume: 1278.4145202576165
  • Molar Volume: 16.03915039712341
  • Full Formula: K3 In21 S24
  • Reduced Formula: KIn7S8
  • Formula Anonymous: AB7C8
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -201.61675076
  • Final energy per atom: -4.200348974166666
  • 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.