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  1. Third-Parties
  2. MatprojStructure
  3. mp-1236223

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-1236223
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 13
  • Number of elements: 4
  • Element list: ['K', 'Li', 'C', 'O']
  • Chemical System: C-K-Li-O
  • Density: 1.7484634977196125
  • Atomic Density: 0.04830861010621658
  • Unit Cell Volume: 269.1031675599191
  • Molar Volume: 12.465978107751525
  • Full Formula: K4 Li1 C2 O6
  • Reduced Formula: K4Li(CO3)2
  • Formula Anonymous: AB2C4D6
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2

Thermodynamics:

  • Final energy: -78.97067104
  • Final energy per atom: -6.074667003076923
  • 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.