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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200729

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-1200729
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 5
  • Element list: ['Na', 'Ga', 'P', 'N', 'O']
  • Chemical System: Ga-N-Na-O-P
  • Density: 2.0554252262451604
  • Atomic Density: 0.06247122953856174
  • Unit Cell Volume: 640.2947452044164
  • Molar Volume: 9.639862708773327
  • Full Formula: Na3 Ga1 P6 N6 O24
  • Reduced Formula: Na3GaP6(NO4)6
  • Formula Anonymous: AB3C6D6E24
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -250.17008254
  • Final energy per atom: -6.2542520635
  • 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.