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  1. Third-Parties
  2. MatprojStructure
  3. mp-555089

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-555089
  • 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: 64
  • Number of elements: 5
  • Element list: ['Sr', 'Li', 'Ca', 'Si', 'O']
  • Chemical System: Ca-Li-O-Si-Sr
  • Density: 3.1362350470821267
  • Atomic Density: 0.08897658753425393
  • Unit Cell Volume: 719.2903411289119
  • Molar Volume: 6.768230752479257
  • Full Formula: Sr4 Li16 Ca4 Si8 O32
  • Reduced Formula: SrLi4Ca(SiO4)2
  • Formula Anonymous: ABC2D4E8
  • Spacegroup Number: 57
  • Spacegroup Symbol: Pbcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -442.13584493
  • Final energy per atom: -6.90837257703125
  • 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.