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  1. Third-Parties
  2. MatprojStructure
  3. mp-555320

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-555320
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Li', 'C', 'O']
  • Chemical System: C-Li-O
  • Density: 2.203450425905598
  • Atomic Density: 0.11508408086130888
  • Unit Cell Volume: 156.40738376050737
  • Molar Volume: 5.232818227272853
  • Full Formula: Li8 C2 O8
  • Reduced Formula: Li4CO4
  • Formula Anonymous: AB4C4
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -110.2654175
  • Final energy per atom: -6.125856527777778
  • 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.