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  1. Third-Parties
  2. MatprojStructure
  3. mp-1214971

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-1214971
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 52
  • Number of elements: 4
  • Element list: ['Ag', 'Ge', 'S', 'Cl']
  • Chemical System: Ag-Cl-Ge-S
  • Density: 5.250825515934067
  • Atomic Density: 0.044730025669114985
  • Unit Cell Volume: 1162.530072856738
  • Molar Volume: 13.463307185531406
  • Full Formula: Ag24 Ge4 S16 Cl8
  • Reduced Formula: Ag6Ge(S2Cl)2
  • Formula Anonymous: AB2C4D6
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -193.96101511
  • Final energy per atom: -3.7300195213461538
  • 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.