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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202819

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-1202819
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 72
  • Number of elements: 4
  • Element list: ['Sr', 'B', 'H', 'O']
  • Chemical System: B-H-O-Sr
  • Density: 3.2347292199682096
  • Atomic Density: 0.08983926556472047
  • Unit Cell Volume: 801.4313067611955
  • Molar Volume: 6.703239081648138
  • Full Formula: Sr8 B20 H4 O40
  • Reduced Formula: Sr2B5HO10
  • Formula Anonymous: AB2C5D10
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -571.04376835
  • Final energy per atom: -7.931163449305556
  • 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.