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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202365

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-1202365
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 118
  • Number of elements: 4
  • Element list: ['Na', 'Y', 'Si', 'O']
  • Chemical System: Na-O-Si-Y
  • Density: 2.361541331650016
  • Atomic Density: 0.061531669680036705
  • Unit Cell Volume: 1917.7116534233078
  • Molar Volume: 9.787058910175844
  • Full Formula: Na16 Y6 Si24 O72
  • Reduced Formula: Na8Y3(SiO3)12
  • Formula Anonymous: A3B8C12D36
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -879.3356634
  • Final energy per atom: -7.451997147457628
  • 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.