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  1. Third-Parties
  2. MatprojStructure
  3. mp-1228721

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-1228721
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 14
  • Number of elements: 4
  • Element list: ['Al', 'In', 'Ag', 'Se']
  • Chemical System: Ag-Al-In-Se
  • Density: 4.280431808074083
  • Atomic Density: 0.03750243660773717
  • Unit Cell Volume: 373.30907712571513
  • Molar Volume: 16.057998638833947
  • Full Formula: Al4 In1 Ag1 Se8
  • Reduced Formula: Al4InAgSe8
  • Formula Anonymous: ABC4D8
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -62.4613489
  • Final energy per atom: -4.4615249214285715
  • 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.