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  1. Third-Parties
  2. MatprojStructure
  3. mp-1223912

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-1223912
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 5
  • Element list: ['In', 'Ga', 'Ag', 'Te', 'Se']
  • Chemical System: Ag-Ga-In-Se-Te
  • Density: 5.5577344207071535
  • Atomic Density: 0.03291818636229904
  • Unit Cell Volume: 243.02675463197275
  • Molar Volume: 18.294266560496524
  • Full Formula: In1 Ga1 Ag2 Te2 Se2
  • Reduced Formula: InGaAg2(TeSe)2
  • Formula Anonymous: ABC2D2E2
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -29.29901578
  • Final energy per atom: -3.6623769725
  • 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.