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  1. Third-Parties
  2. MatprojStructure
  3. mp-560193

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-560193
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 4
  • Element list: ['Sn', 'Se', 'Cl', 'O']
  • Chemical System: Cl-O-Se-Sn
  • Density: 2.5045777351226324
  • Atomic Density: 0.03310713866042959
  • Unit Cell Volume: 785.3291178882758
  • Molar Volume: 18.18985573403781
  • Full Formula: Sn2 Se4 Cl16 O4
  • Reduced Formula: SnSe2(Cl4O)2
  • Formula Anonymous: AB2C2D8
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -101.41264979
  • Final energy per atom: -3.9004865303846157
  • 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.