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  1. Third-Parties
  2. MatprojStructure
  3. mp-24802

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-24802
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 88
  • Number of elements: 5
  • Element list: ['Sr', 'Al', 'Si', 'H', 'O']
  • Chemical System: Al-H-O-Si-Sr
  • Density: 3.754789924353021
  • Atomic Density: 0.09053947274465882
  • Unit Cell Volume: 971.9517612851504
  • Molar Volume: 6.651398089078516
  • Full Formula: Sr8 Al12 Si12 H4 O52
  • Reduced Formula: Sr2Al3Si3HO13
  • Formula Anonymous: AB2C3D3E13
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -682.43270253
  • Final energy per atom: -7.7549170742045455
  • 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.