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  1. Third-Parties
  2. MatprojStructure
  3. mp-556250

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-556250
  • 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: 64
  • Number of elements: 4
  • Element list: ['K', 'Sr', 'B', 'O']
  • Chemical System: B-K-O-Sr
  • Density: 2.7552835680606567
  • Atomic Density: 0.08174554436598148
  • Unit Cell Volume: 782.9172892098775
  • Molar Volume: 7.3669345610304875
  • Full Formula: K4 Sr4 B20 O36
  • Reduced Formula: KSrB5O9
  • Formula Anonymous: ABC5D9
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -512.29056919
  • Final energy per atom: -8.00454014359375
  • 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.