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  1. Third-Parties
  2. MatprojStructure
  3. mp-1178153

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-1178153
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 38
  • Number of elements: 4
  • Element list: ['K', 'Li', 'Cr', 'O']
  • Chemical System: Cr-K-Li-O
  • Density: 2.6603473834060836
  • Atomic Density: 0.07194731797990926
  • Unit Cell Volume: 528.1642327600205
  • Molar Volume: 8.370208826521703
  • Full Formula: K8 Li10 Cr4 O16
  • Reduced Formula: K4Li5Cr2O8
  • Formula Anonymous: A2B4C5D8
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -220.0742642
  • Final energy per atom: -5.791428005263158
  • 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.