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  1. Third-Parties
  2. MatprojStructure
  3. mp-1195280

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-1195280
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 96
  • Number of elements: 3
  • Element list: ['Mg', 'Si', 'Bi']
  • Chemical System: Bi-Mg-Si
  • Density: 2.1095142664428836
  • Atomic Density: 0.04628061405535393
  • Unit Cell Volume: 2074.302641818434
  • Molar Volume: 13.012231758198407
  • Full Formula: Mg64 Si31 Bi1
  • Reduced Formula: Mg64Si31Bi
  • Formula Anonymous: AB31C64
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -283.14056607
  • Final energy per atom: -2.9493808965625
  • 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.