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  1. Third-Parties
  2. MatprojStructure
  3. mp-1205094

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-1205094
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 32
  • Number of elements: 3
  • Element list: ['Sm', 'Ag', 'S']
  • Chemical System: Ag-S-Sm
  • Density: 5.4117996225580765
  • Atomic Density: 0.040440254478678966
  • Unit Cell Volume: 791.2907673929484
  • Molar Volume: 14.891451197902354
  • Full Formula: Sm8 Ag8 S16
  • Reduced Formula: SmAgS2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -176.53490559
  • Final energy per atom: -5.5167157996875
  • 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.