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  1. Third-Parties
  2. MatprojStructure
  3. mp-673833

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-673833
  • 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: 24
  • Number of elements: 3
  • Element list: ['Li', 'V', 'As']
  • Chemical System: As-Li-V
  • Density: 3.0633328731236746
  • Atomic Density: 0.05545230429944722
  • Unit Cell Volume: 432.8043767198191
  • Molar Volume: 10.860036992295074
  • Full Formula: Li14 V2 As8
  • Reduced Formula: Li7VAs4
  • Formula Anonymous: AB4C7
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -97.75131546
  • Final energy per atom: -4.0729714775
  • 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.