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  1. Third-Parties
  2. MatprojStructure
  3. mp-1105656

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-1105656
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 17
  • Number of elements: 3
  • Element list: ['Sm', 'Mg', 'Ge']
  • Chemical System: Ge-Mg-Sm
  • Density: 5.2098924378011935
  • Atomic Density: 0.04417453779086668
  • Unit Cell Volume: 384.83707697140505
  • Molar Volume: 13.632606159933857
  • Full Formula: Sm4 Mg7 Ge6
  • Reduced Formula: Sm4Mg7Ge6
  • Formula Anonymous: A4B6C7
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -67.22394738
  • Final energy per atom: -3.9543498458823527
  • 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.