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  1. Third-Parties
  2. MatprojStructure
  3. mp-780435

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-780435
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:40 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 88
  • Number of elements: 4
  • Element list: ['Li', 'Co', 'P', 'O']
  • Chemical System: Co-Li-O-P
  • Density: 3.0604905359127277
  • Atomic Density: 0.0926831924775116
  • Unit Cell Volume: 949.4709628323612
  • Molar Volume: 6.497554301942281
  • Full Formula: Li20 Co8 P12 O48
  • Reduced Formula: Li5Co2(PO4)3
  • Formula Anonymous: A2B3C5D12
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -605.10865631
  • Final energy per atom: -6.8762347307954546
  • 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.