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  1. Third-Parties
  2. MatprojStructure
  3. mp-1227830

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-1227830
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 30
  • Number of elements: 4
  • Element list: ['Ba', 'Sr', 'Sn', 'O']
  • Chemical System: Ba-O-Sn-Sr
  • Density: 6.371376238040495
  • Atomic Density: 0.07081897589502355
  • Unit Cell Volume: 423.6152757203045
  • Molar Volume: 8.503569394912947
  • Full Formula: Ba2 Sr4 Sn6 O18
  • Reduced Formula: BaSr2(SnO3)3
  • Formula Anonymous: AB2C3D9
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -202.00054273
  • Final energy per atom: -6.733351424333334
  • 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.