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  1. Third-Parties
  2. MatprojStructure
  3. mp-556215

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-556215
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 54
  • Number of elements: 4
  • Element list: ['K', 'Li', 'I', 'O']
  • Chemical System: I-K-Li-O
  • Density: 2.9984884223273296
  • Atomic Density: 0.058423302325185035
  • Unit Cell Volume: 924.2887315652774
  • Molar Volume: 10.307771934014733
  • Full Formula: K18 Li6 I4 O26
  • Reduced Formula: K9Li3I2O13
  • Formula Anonymous: A2B3C9D13
  • Spacegroup Number: 190
  • Spacegroup Symbol: P-62c
  • Crystal System: hexagonal
  • Pointgroup: -62m

Thermodynamics:

  • Final energy: -253.08096707
  • Final energy per atom: -4.6866845753703705
  • 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.