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  1. Third-Parties
  2. MatprojStructure
  3. mp-505627

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-505627
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 24
  • Number of elements: 3
  • Element list: ['Nb', 'Co', 'Si']
  • Chemical System: Co-Nb-Si
  • Density: 8.050894476288983
  • Atomic Density: 0.06850048584223932
  • Unit Cell Volume: 350.36247852713666
  • Molar Volume: 8.791384011303727
  • Full Formula: Nb12 Co8 Si4
  • Reduced Formula: Nb3Co2Si
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -208.51640254
  • Final energy per atom: -8.688183439166666
  • 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.