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  1. Third-Parties
  2. MatprojStructure
  3. mp-555604

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-555604
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 100
  • Number of elements: 4
  • Element list: ['Na', 'Dy', 'Si', 'O']
  • Chemical System: Dy-Na-O-Si
  • Density: 2.999935353491837
  • Atomic Density: 0.07057338468086598
  • Unit Cell Volume: 1416.9647729409842
  • Molar Volume: 8.533161314612046
  • Full Formula: Na12 Dy4 Si24 O60
  • Reduced Formula: Na3Dy(Si2O5)3
  • Formula Anonymous: AB3C6D15
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -778.0479187000001
  • Final energy per atom: -7.780479187000001
  • 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.