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  1. Third-Parties
  2. MatprojStructure
  3. mp-555314

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-555314
  • 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: 35
  • Number of elements: 4
  • Element list: ['Sr', 'Zr', 'Si', 'O']
  • Chemical System: O-Si-Sr-Zr
  • Density: 3.8079621683378315
  • Atomic Density: 0.06638380443625273
  • Unit Cell Volume: 527.2370316409015
  • Molar Volume: 9.071701766931664
  • Full Formula: Sr7 Zr1 Si6 O21
  • Reduced Formula: Sr7Zr(Si2O7)3
  • Formula Anonymous: AB6C7D21
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -277.66064024
  • Final energy per atom: -7.933161149714286
  • 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.