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  1. Third-Parties
  2. MatprojStructure
  3. mp-1105327

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-1105327
  • 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: 18
  • Number of elements: 3
  • Element list: ['Cr', 'Si', 'C']
  • Chemical System: C-Cr-Si
  • Density: 5.902310642483412
  • Atomic Density: 0.08979732629714696
  • Unit Cell Volume: 200.45140253326113
  • Molar Volume: 6.706369786637328
  • Full Formula: Cr10 Si6 C2
  • Reduced Formula: Cr5Si3C
  • Formula Anonymous: AB3C5
  • Spacegroup Number: 193
  • Spacegroup Symbol: P6_3/mcm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm

Thermodynamics:

  • Final energy: -151.92126418
  • Final energy per atom: -8.440070232222222
  • 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.