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  1. Third-Parties
  2. MatprojStructure
  3. mp-1221042

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-1221042
  • 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: 36
  • Number of elements: 4
  • Element list: ['Na', 'Ga', 'Ag', 'Te']
  • Chemical System: Ag-Ga-Na-Te
  • Density: 5.32454853619274
  • Atomic Density: 0.031622536086271566
  • Unit Cell Volume: 1138.428616281312
  • Molar Volume: 19.043826034605804
  • Full Formula: Na2 Ga12 Ag2 Te20
  • Reduced Formula: NaGa6AgTe10
  • Formula Anonymous: ABC6D10
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -129.443481
  • Final energy per atom: -3.5956522499999997
  • 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.