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  1. Third-Parties
  2. MatprojStructure
  3. mp-584674

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-584674
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 4
  • Element list: ['Li', 'Co', 'P', 'O']
  • Chemical System: Co-Li-O-P
  • Density: 2.4421764401126467
  • Atomic Density: 0.06800084842764435
  • Unit Cell Volume: 823.5191368176276
  • Molar Volume: 8.855978857981164
  • Full Formula: Li4 Co4 P12 O36
  • Reduced Formula: LiCo(PO3)3
  • Formula Anonymous: ABC3D9
  • Spacegroup Number: 57
  • Spacegroup Symbol: Pbcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -418.07502345
  • Final energy per atom: -7.46562541875
  • 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.