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  1. Third-Parties
  2. MatprojStructure
  3. mp-626561

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-626561
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 23
  • Number of elements: 3
  • Element list: ['V', 'H', 'O']
  • Chemical System: H-O-V
  • Density: 3.447133494920066
  • Atomic Density: 0.09223194351085011
  • Unit Cell Volume: 249.3713037424425
  • Molar Volume: 6.529343881050885
  • Full Formula: V6 H4 O13
  • Reduced Formula: V6H4O13
  • Formula Anonymous: A4B6C13
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -180.84329403
  • Final energy per atom: -7.862751914347826
  • 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.