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  1. Third-Parties
  2. MatprojStructure
  3. mp-559330

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-559330
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 86
  • Number of elements: 3
  • Element list: ['Sr', 'B', 'O']
  • Chemical System: B-O-Sr
  • Density: 3.128791441209384
  • Atomic Density: 0.08984141677972805
  • Unit Cell Volume: 957.2422506520975
  • Molar Volume: 6.703078575402479
  • Full Formula: Sr8 B28 O50
  • Reduced Formula: Sr4B14O25
  • Formula Anonymous: A4B14C25
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -709.8868498
  • Final energy per atom: -8.254498253488373
  • 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.