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  1. Third-Parties
  2. MatprojStructure
  3. mp-622214

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-622214
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 76
  • Number of elements: 4
  • Element list: ['Cs', 'Co', 'Mo', 'O']
  • Chemical System: Co-Cs-Mo-O
  • Density: 4.2843319029225295
  • Atomic Density: 0.0567714846466039
  • Unit Cell Volume: 1338.700237858697
  • Molar Volume: 10.607685878724414
  • Full Formula: Cs8 Co8 Mo12 O48
  • Reduced Formula: Cs2Co2(MoO4)3
  • Formula Anonymous: A2B2C3D12
  • Spacegroup Number: 198
  • Spacegroup Symbol: P2_13
  • Crystal System: cubic
  • Pointgroup: 23

Thermodynamics:

  • Final energy: -576.66303133
  • Final energy per atom: -7.5876714648684205
  • 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.