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  1. Third-Parties
  2. MatprojStructure
  3. mp-1208788

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-1208788
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 46
  • Number of elements: 5
  • Element list: ['Sr', 'Ti', 'Si', 'H', 'O']
  • Chemical System: H-O-Si-Sr-Ti
  • Density: 3.2153778477789423
  • Atomic Density: 0.07034839012965871
  • Unit Cell Volume: 653.8884531005992
  • Molar Volume: 8.560452838935797
  • Full Formula: Sr6 Ti2 Si8 H4 O26
  • Reduced Formula: Sr3TiSi4H2O13
  • Formula Anonymous: AB2C3D4E13
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -344.33058826
  • Final energy per atom: -7.485447570869566
  • 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.