Download Simmate

You can install Simmate to host your own server and access advanced features

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-1254259

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-1254259
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 46
  • Number of elements: 4
  • Element list: ['Mg', 'Co', 'Si', 'O']
  • Chemical System: Co-Mg-O-Si
  • Density: 3.4078524062431548
  • Atomic Density: 0.08954764090397851
  • Unit Cell Volume: 513.6930413312124
  • Molar Volume: 6.725069135497955
  • Full Formula: Mg6 Co4 Si8 O28
  • Reduced Formula: Mg3Co2(Si2O7)2
  • Formula Anonymous: A2B3C4D14
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -345.12863309
  • Final energy per atom: -7.502796371521739
  • 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.