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  1. Third-Parties
  2. MatprojStructure
  3. mp-4182

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-4182
  • 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: 8
  • Number of elements: 3
  • Element list: ['Cr', 'Ag', 'S']
  • Chemical System: Ag-Cr-S
  • Density: 5.029493241696318
  • Atomic Density: 0.05408765537950014
  • Unit Cell Volume: 147.9080567251228
  • Molar Volume: 11.134039214209427
  • Full Formula: Cr2 Ag2 S4
  • Reduced Formula: CrAgS2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m

Thermodynamics:

  • Final energy: -47.3365861
  • Final energy per atom: -5.9170732625
  • 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.