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  1. Third-Parties
  2. MatprojStructure
  3. mp-734495

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-734495
  • 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: 5
  • Element list: ['V', 'Zn', 'H', 'Pb', 'O']
  • Chemical System: H-O-Pb-V-Zn
  • Density: 5.912798859583029
  • Atomic Density: 0.07921519069735797
  • Unit Cell Volume: 454.4582886575149
  • Molar Volume: 7.602254955122962
  • Full Formula: V4 Zn4 H4 Pb4 O20
  • Reduced Formula: VZnHPbO5
  • Formula Anonymous: ABCDE5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -238.46915182
  • Final energy per atom: -6.624143106111111
  • 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.