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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202473

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-1202473
  • 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: 132
  • Number of elements: 6
  • Element list: ['Ga', 'Sb', 'H', 'C', 'S', 'N']
  • Chemical System: C-Ga-H-N-S-Sb
  • Density: 2.144832957474785
  • Atomic Density: 0.06092645141417509
  • Unit Cell Volume: 2166.5466630030746
  • Molar Volume: 9.884279520994545
  • Full Formula: Ga8 Sb8 H64 C16 S28 N8
  • Reduced Formula: Ga2Sb2H16C4S7N2
  • Formula Anonymous: A2B2C2D4E7F16
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -661.6270115
  • Final energy per atom: -5.01232584469697
  • 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.