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  1. Third-Parties
  2. MatprojStructure
  3. mp-571103

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-571103
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 14
  • Number of elements: 3
  • Element list: ['In', 'Ag', 'Se']
  • Chemical System: Ag-In-Se
  • Density: 5.200053967774661
  • Atomic Density: 0.03337421197868672
  • Unit Cell Volume: 419.48555995690964
  • Molar Volume: 18.044293491770926
  • Full Formula: In5 Ag1 Se8
  • Reduced Formula: In5AgSe8
  • Formula Anonymous: AB5C8
  • Spacegroup Number: 111
  • Spacegroup Symbol: P-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m

Thermodynamics:

  • Final energy: -55.20104264
  • Final energy per atom: -3.942931617142857
  • 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.