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  1. Third-Parties
  2. MatprojStructure
  3. mp-642418

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-642418
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 3
  • Element list: ['Sr', 'In', 'Ga']
  • Chemical System: Ga-In-Sr
  • Density: 3.9625670615164093
  • Atomic Density: 0.027063108661947378
  • Unit Cell Volume: 1330.2241235360561
  • Molar Volume: 22.252213650782668
  • Full Formula: Sr22 In6 Ga8
  • Reduced Formula: Sr11In3Ga4
  • Formula Anonymous: A3B4C11
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -90.70734773
  • Final energy per atom: -2.5196485480555553
  • 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.