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  1. Third-Parties
  2. MatprojStructure
  3. mp-29884

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-29884
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 42
  • Number of elements: 3
  • Element list: ['Zn', 'Ni', 'P']
  • Chemical System: Ni-P-Zn
  • Density: 7.841282344745233
  • Atomic Density: 0.08870655644082244
  • Unit Cell Volume: 473.47120308991896
  • Molar Volume: 6.788833882890568
  • Full Formula: Zn3 Ni30 P9
  • Reduced Formula: ZnNi10P3
  • Formula Anonymous: AB3C10
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1

Thermodynamics:

  • Final energy: -243.7822267
  • Final energy per atom: -5.804338730952381
  • 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.