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  1. Third-Parties
  2. MatprojStructure
  3. mp-1203285

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-1203285
  • 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: 46
  • Number of elements: 5
  • Element list: ['Sn', 'H', 'C', 'S', 'Cl']
  • Chemical System: C-Cl-H-S-Sn
  • Density: 1.6896765208176239
  • Atomic Density: 0.06082168401201668
  • Unit Cell Volume: 756.3092135185154
  • Molar Volume: 9.901305525855205
  • Full Formula: Sn2 H24 C8 S4 Cl8
  • Reduced Formula: SnH12C4(SCl2)2
  • Formula Anonymous: AB2C4D4E12
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -217.9624142
  • Final energy per atom: -4.738313352173913
  • 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.