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  1. Third-Parties
  2. MatprojStructure
  3. mp-1044762

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-1044762
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 4
  • Element list: ['Pr', 'V', 'Zn', 'O']
  • Chemical System: O-Pr-V-Zn
  • Density: 5.807876167640912
  • Atomic Density: 0.08653188919156889
  • Unit Cell Volume: 231.12866466746078
  • Molar Volume: 6.959446761491437
  • Full Formula: Pr2 V4 Zn2 O12
  • Reduced Formula: PrV2ZnO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 7
  • Spacegroup Symbol: P1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -160.66744626999997
  • Final energy per atom: -8.0333723135
  • 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.