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  1. Third-Parties
  2. MatprojStructure
  3. mp-560368

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-560368
  • 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: 55
  • Number of elements: 4
  • Element list: ['Na', 'Cu', 'P', 'O']
  • Chemical System: Cu-Na-O-P
  • Density: 3.7108354007384463
  • Atomic Density: 0.08363329194725497
  • Unit Cell Volume: 657.6328483480821
  • Molar Volume: 7.20065014754888
  • Full Formula: Na6 Cu9 P8 O32
  • Reduced Formula: Na6Cu9(PO4)8
  • Formula Anonymous: A6B8C9D32
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -362.11912604
  • Final energy per atom: -6.583984109818182
  • 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.