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  1. Third-Parties
  2. MatprojStructure
  3. mp-676430

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-676430
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 17
  • Number of elements: 3
  • Element list: ['Ag', 'S', 'I']
  • Chemical System: Ag-I-S
  • Density: 6.496548997931401
  • Atomic Density: 0.04139520116679134
  • Unit Cell Volume: 410.6756223143563
  • Molar Volume: 14.54792002516265
  • Full Formula: Ag9 S4 I4
  • Reduced Formula: Ag9(SI)4
  • Formula Anonymous: A4B4C9
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -51.74065043
  • Final energy per atom: -3.0435676723529412
  • 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.