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  1. Third-Parties
  2. MatprojStructure
  3. mp-558990

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-558990
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 19
  • Number of elements: 4
  • Element list: ['K', 'Sr', 'P', 'O']
  • Chemical System: K-O-P-Sr
  • Density: 2.713496095393544
  • Atomic Density: 0.06445447093578242
  • Unit Cell Volume: 294.78172303873487
  • Molar Volume: 9.34324752428735
  • Full Formula: K2 Sr1 P4 O12
  • Reduced Formula: K2Sr(PO3)4
  • Formula Anonymous: AB2C4D12
  • Spacegroup Number: 82
  • Spacegroup Symbol: I-4
  • Crystal System: tetragonal
  • Pointgroup: -4

Thermodynamics:

  • Final energy: -138.9129135
  • Final energy per atom: -7.311205973684211
  • 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.