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  1. Third-Parties
  2. MatprojStructure
  3. mp-725545

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-725545
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 5
  • Element list: ['Ag', 'W', 'C', 'S', 'N']
  • Chemical System: Ag-C-N-S-W
  • Density: 1.9662726396950376
  • Atomic Density: 0.03738762124633819
  • Unit Cell Volume: 962.8855433942833
  • Molar Volume: 16.107311883581843
  • Full Formula: Ag2 W2 C18 S8 N6
  • Reduced Formula: AgWC9S4N3
  • Formula Anonymous: ABC3D4E9
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -237.6843154
  • Final energy per atom: -6.602342094444444
  • 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.