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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200236

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-1200236
  • 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: 60
  • Number of elements: 5
  • Element list: ['Sn', 'H', 'C', 'I', 'N']
  • Chemical System: C-H-I-N-Sn
  • Density: 3.0719593262904477
  • Atomic Density: 0.05086873081657063
  • Unit Cell Volume: 1179.506526639246
  • Molar Volume: 11.83859055126705
  • Full Formula: Sn4 H32 C8 I12 N4
  • Reduced Formula: SnH8C2I3N
  • Formula Anonymous: ABC2D3E8
  • Spacegroup Number: 33
  • Spacegroup Symbol: Pna2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -274.50318929
  • Final energy per atom: -4.575053154833333
  • 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.