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  1. Third-Parties
  2. MatprojStructure
  3. mp-1329345

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-1329345
  • 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: 56
  • Number of elements: 5
  • Element list: ['Zn', 'Ni', 'P', 'W', 'O']
  • Chemical System: Ni-O-P-W-Zn
  • Density: 4.73182235804402
  • Atomic Density: 0.0776321888647209
  • Unit Cell Volume: 721.3502648699448
  • Molar Volume: 7.757272914839448
  • Full Formula: Zn4 Ni4 P8 W4 O36
  • Reduced Formula: ZnNiP2WO9
  • Formula Anonymous: ABCD2E9
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -424.73716126
  • Final energy per atom: -7.584592165357143
  • 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.