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  1. Third-Parties
  2. MatprojStructure
  3. mp-1197507

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-1197507
  • 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: 192
  • Number of elements: 4
  • Element list: ['Sr', 'Mo', 'H', 'O']
  • Chemical System: H-Mo-O-Sr
  • Density: 3.9647159443807345
  • Atomic Density: 0.08009835745803892
  • Unit Cell Volume: 2397.0528996251005
  • Molar Volume: 7.518432276410681
  • Full Formula: Sr8 Mo32 H32 O120
  • Reduced Formula: SrMo4H4O15
  • Formula Anonymous: AB4C4D15
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -1434.83096467
  • Final energy per atom: -7.473077940989583
  • 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.