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  1. Third-Parties
  2. MatprojStructure
  3. mp-1214991

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-1214991
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 160
  • Number of elements: 4
  • Element list: ['Cs', 'Zn', 'Si', 'O']
  • Chemical System: Cs-O-Si-Zn
  • Density: 3.270223308605813
  • Atomic Density: 0.059350669158066645
  • Unit Cell Volume: 2695.8415510678974
  • Molar Volume: 10.146710804492255
  • Full Formula: Cs16 Zn8 Si40 O96
  • Reduced Formula: Cs2ZnSi5O12
  • Formula Anonymous: AB2C5D12
  • Spacegroup Number: 61
  • Spacegroup Symbol: Pbca
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -1196.36376188
  • Final energy per atom: -7.477273511750001
  • 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.