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  1. Third-Parties
  2. MatprojStructure
  3. mp-18411

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-18411
  • 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: 28
  • Number of elements: 3
  • Element list: ['Na', 'Ge', 'Se']
  • Chemical System: Ge-Na-Se
  • Density: 3.3652661506783472
  • Atomic Density: 0.037481308531107434
  • Unit Cell Volume: 747.0390201761909
  • Molar Volume: 16.067050473976792
  • Full Formula: Na12 Ge4 Se12
  • Reduced Formula: Na3GeSe3
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -106.24013534
  • Final energy per atom: -3.7942905478571425
  • 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.