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  1. Third-Parties
  2. MatprojStructure
  3. mp-1192566

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-1192566
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 5
  • Element list: ['V', 'Pb', 'Se', 'Cl', 'O']
  • Chemical System: Cl-O-Pb-Se-V
  • Density: 5.589158561136424
  • Atomic Density: 0.05989779894090041
  • Unit Cell Volume: 467.46292009205325
  • Molar Volume: 10.054026803124916
  • Full Formula: V2 Pb4 Se4 Cl2 O16
  • Reduced Formula: VPb2Se2ClO8
  • Formula Anonymous: ABC2D2E8
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -176.46173477
  • Final energy per atom: -6.302204813214286
  • 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.