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  1. Third-Parties
  2. MatprojStructure
  3. mp-559880

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-559880
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 84
  • Number of elements: 4
  • Element list: ['K', 'Ag', 'Sn', 'S']
  • Chemical System: Ag-K-S-Sn
  • Density: 4.318155575478822
  • Atomic Density: 0.03894600522056895
  • Unit Cell Volume: 2156.832248243941
  • Molar Volume: 15.462794517419379
  • Full Formula: K8 Ag24 Sn12 S40
  • Reduced Formula: K2Ag6Sn3S10
  • Formula Anonymous: A2B3C6D10
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -346.39810084
  • Final energy per atom: -4.123786914761904
  • 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.