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  1. Third-Parties
  2. MatprojStructure
  3. mp-5012

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-5012
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Li', 'Si', 'O']
  • Chemical System: Li-O-Si
  • Density: 2.458383181249841
  • Atomic Density: 0.09873582641797486
  • Unit Cell Volume: 121.5364314590413
  • Molar Volume: 6.0992458142869905
  • Full Formula: Li4 Si2 O6
  • Reduced Formula: Li2SiO3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -82.76883259
  • Final energy per atom: -6.8974027158333335
  • 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.