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  1. Third-Parties
  2. MatprojStructure
  3. mp-21965

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-21965
  • 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: 49
  • Number of elements: 2
  • Element list: ['V', 'Ga']
  • Chemical System: Ga-V
  • Density: 6.419345183006591
  • Atomic Density: 0.05799602943290552
  • Unit Cell Volume: 844.8854254184271
  • Molar Volume: 10.383712159065817
  • Full Formula: V8 Ga41
  • Reduced Formula: V8Ga41
  • Formula Anonymous: A8B41
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -205.69196538000003
  • Final energy per atom: -4.197795211836735
  • 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.