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  1. Third-Parties
  2. MatprojStructure
  3. mp-558500

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-558500
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:40 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 4
  • Element list: ['K', 'Ag', 'Ge', 'S']
  • Chemical System: Ag-Ge-K-S
  • Density: 3.523747712574194
  • Atomic Density: 0.03859575707696305
  • Unit Cell Volume: 466.37250732267154
  • Molar Volume: 15.603116031618105
  • Full Formula: K4 Ag4 Ge2 S8
  • Reduced Formula: K2Ag2GeS4
  • Formula Anonymous: AB2C2D4
  • Spacegroup Number: 70
  • Spacegroup Symbol: Fddd1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -74.19819373
  • Final energy per atom: -4.122121873888889
  • 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.