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  1. Third-Parties
  2. MatprojStructure
  3. mp-24126

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-24126
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 116
  • Number of elements: 4
  • Element list: ['Sr', 'Al', 'H', 'O']
  • Chemical System: Al-H-O-Sr
  • Density: 3.0062867548506613
  • Atomic Density: 0.10078958206231176
  • Unit Cell Volume: 1150.9126005531466
  • Molar Volume: 5.974963519817847
  • Full Formula: Sr12 Al8 H48 O48
  • Reduced Formula: Sr3Al2(HO)12
  • Formula Anonymous: A2B3C12D12
  • Spacegroup Number: 230
  • Spacegroup Symbol: Ia-3d
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -693.3225044
  • Final energy per atom: -5.9769181413793095
  • 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.