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  1. Third-Parties
  2. MatprojStructure
  3. mp-554260

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-554260
  • 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: 46
  • Number of elements: 4
  • Element list: ['Sn', 'Sb', 'As', 'F']
  • Chemical System: As-F-Sb-Sn
  • Density: 3.4637394637742074
  • Atomic Density: 0.05617505129308439
  • Unit Cell Volume: 818.8688562116716
  • Molar Volume: 10.720311991493235
  • Full Formula: Sn2 Sb4 As4 F36
  • Reduced Formula: SnSb2As2F18
  • Formula Anonymous: AB2C2D18
  • Spacegroup Number: 7
  • Spacegroup Symbol: P1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -231.86221782
  • Final energy per atom: -5.040482996086957
  • 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.