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  1. Third-Parties
  2. MatprojStructure
  3. mp-1204733

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-1204733
  • 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: 34
  • Number of elements: 6
  • Element list: ['Ge', 'Bi', 'H', 'C', 'S', 'N']
  • Chemical System: Bi-C-Ge-H-N-S
  • Density: 2.882539551225853
  • Atomic Density: 0.06471976105150487
  • Unit Cell Volume: 525.3418654148358
  • Molar Volume: 9.304949001909167
  • Full Formula: Ge2 Bi2 H16 C4 S8 N2
  • Reduced Formula: GeBiH8C2S4N
  • Formula Anonymous: ABCD2E4F8
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -171.53423939
  • Final energy per atom: -5.045124687941176
  • 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.