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  1. Third-Parties
  2. MatprojStructure
  3. mp-559335

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-559335
  • 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: 30
  • Number of elements: 5
  • Element list: ['Zn', 'Ag', 'C', 'S', 'N']
  • Chemical System: Ag-C-N-S-Zn
  • Density: 2.6275360346488292
  • Atomic Density: 0.04622442725963984
  • Unit Cell Volume: 649.0075005470981
  • Molar Volume: 13.028048408634671
  • Full Formula: Zn2 Ag4 C8 S8 N8
  • Reduced Formula: ZnAg2C4(SN)4
  • Formula Anonymous: AB2C4D4E4
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -191.07217287
  • Final energy per atom: -6.369072429
  • 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.