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  1. Third-Parties
  2. MatprojStructure
  3. mp-562220

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-562220
  • 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: 64
  • Number of elements: 4
  • Element list: ['Co', 'Sb', 'C', 'O']
  • Chemical System: C-Co-O-Sb
  • Density: 2.8233945184067295
  • Atomic Density: 0.05138306055300023
  • Unit Cell Volume: 1245.5466706578472
  • Molar Volume: 11.720089646642059
  • Full Formula: Co8 Sb8 C24 O24
  • Reduced Formula: CoSb(CO)3
  • Formula Anonymous: ABC3D3
  • Spacegroup Number: 141
  • Spacegroup Symbol: I4_1/amd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -475.90445067
  • Final energy per atom: -7.43600704171875
  • 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.