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  1. Third-Parties
  2. MatprojStructure
  3. mp-555363

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-555363
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 66
  • Number of elements: 4
  • Element list: ['Na', 'Cd', 'Si', 'O']
  • Chemical System: Cd-Na-O-Si
  • Density: 3.6408872626575235
  • Atomic Density: 0.07766193086508817
  • Unit Cell Volume: 849.8372273881922
  • Molar Volume: 7.754302130939122
  • Full Formula: Na12 Cd6 Si12 O36
  • Reduced Formula: Na2Cd(SiO3)2
  • Formula Anonymous: AB2C2D6
  • Spacegroup Number: 31
  • Spacegroup Symbol: Pmn2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -437.75878839
  • Final energy per atom: -6.632708915
  • 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.