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  1. Third-Parties
  2. MatprojStructure
  3. mp-1221496

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-1221496
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Mo', 'Os', 'C']
  • Chemical System: C-Mo-Os
  • Density: 14.355575318238659
  • Atomic Density: 0.07836665780919815
  • Unit Cell Volume: 102.08423101924113
  • Molar Volume: 7.684570107177855
  • Full Formula: Mo3 Os3 C2
  • Reduced Formula: Mo3Os3C2
  • Formula Anonymous: A2B3C3
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1

Thermodynamics:

  • Final energy: -83.25955149
  • Final energy per atom: -10.40744393625
  • 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.