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  1. Third-Parties
  2. MatprojStructure
  3. mp-1211943

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-1211943
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 4
  • Element list: ['K', 'In', 'I', 'O']
  • Chemical System: I-In-K-O
  • Density: 4.376896520591023
  • Atomic Density: 0.057589963287425674
  • Unit Cell Volume: 972.3916599930733
  • Molar Volume: 10.45692758987205
  • Full Formula: K6 In2 I12 O36
  • Reduced Formula: K3In(IO3)6
  • Formula Anonymous: AB3C6D18
  • Spacegroup Number: 43
  • Spacegroup Symbol: Fdd2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -278.26348985000004
  • Final energy per atom: -4.968990890178572
  • 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.