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  1. Third-Parties
  2. MatprojStructure
  3. mp-1211928

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-1211928
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 42
  • Number of elements: 5
  • Element list: ['K', 'Sn', 'S', 'Cl', 'O']
  • Chemical System: Cl-K-O-S-Sn
  • Density: 3.6969359785980047
  • Atomic Density: 0.05581954538764227
  • Unit Cell Volume: 752.4246159356622
  • Molar Volume: 10.788587972508326
  • Full Formula: K2 Sn8 S6 Cl2 O24
  • Reduced Formula: KSn4S3ClO12
  • Formula Anonymous: ABC3D4E12
  • Spacegroup Number: 173
  • Spacegroup Symbol: P6_3
  • Crystal System: hexagonal
  • Pointgroup: 6

Thermodynamics:

  • Final energy: -250.71540227
  • Final energy per atom: -5.969414339761904
  • 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.