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  1. Third-Parties
  2. MatprojStructure
  3. mp-16847

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-16847
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 4
  • Element list: ['K', 'Na', 'Sn', 'P']
  • Chemical System: K-Na-P-Sn
  • Density: 2.4336944774057327
  • Atomic Density: 0.03518336685531752
  • Unit Cell Volume: 1023.2107730917475
  • Molar Volume: 17.116442507519235
  • Full Formula: K12 Na8 Sn4 P12
  • Reduced Formula: K3Na2SnP3
  • Formula Anonymous: AB2C3D3
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -119.19102776
  • Final energy per atom: -3.310861882222222
  • 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.