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  1. Third-Parties
  2. MatprojStructure
  3. mp-4824

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-4824
  • 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: 6
  • Number of elements: 3
  • Element list: ['Na', 'Zn', 'P']
  • Chemical System: Na-P-Zn
  • Density: 3.4546517373221883
  • Atomic Density: 0.052284387764192315
  • Unit Cell Volume: 114.75700981831488
  • Molar Volume: 11.51804777204324
  • Full Formula: Na2 Zn2 P2
  • Reduced Formula: NaZnP
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -18.42688402
  • Final energy per atom: -3.0711473366666664
  • 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.