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  1. Third-Parties
  2. MatprojStructure
  3. mp-1197888

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-1197888
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 48
  • Number of elements: 4
  • Element list: ['In', 'Au', 'I', 'N']
  • Chemical System: Au-I-In-N
  • Density: 4.3304375141423685
  • Atomic Density: 0.023094779455393476
  • Unit Cell Volume: 2078.3917894825468
  • Molar Volume: 26.07576648060872
  • Full Formula: In4 Au4 I32 N8
  • Reduced Formula: InAu(I4N)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -119.42118971000002
  • Final energy per atom: -2.487941452291667
  • 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.