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  1. Third-Parties
  2. MatprojStructure
  3. mp-1208976

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-1208976
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 24
  • Number of elements: 3
  • Element list: ['Sm', 'Mg', 'Ni']
  • Chemical System: Mg-Ni-Sm
  • Density: 6.772234264317801
  • Atomic Density: 0.035751951977133975
  • Unit Cell Volume: 671.292018274968
  • Molar Volume: 16.844229271318124
  • Full Formula: Sm16 Mg4 Ni4
  • Reduced Formula: Sm4MgNi
  • Formula Anonymous: ABC4
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -109.17780747
  • Final energy per atom: -4.54907531125
  • 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.