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  1. Third-Parties
  2. MatprojStructure
  3. mp-16432

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-16432
  • 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: 22
  • Number of elements: 3
  • Element list: ['Sr', 'B', 'O']
  • Chemical System: B-O-Sr
  • Density: 4.096278340407782
  • Atomic Density: 0.07131863791284784
  • Unit Cell Volume: 308.4747640144816
  • Molar Volume: 8.443992953649959
  • Full Formula: Sr6 B4 O12
  • Reduced Formula: Sr3(BO3)2
  • Formula Anonymous: A2B3C6
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -167.63248398
  • Final energy per atom: -7.6196583627272725
  • 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.