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  1. Third-Parties
  2. MatprojStructure
  3. mp-1216378

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-1216378
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['V', 'Cr', 'Si']
  • Chemical System: Cr-Si-V
  • Density: 4.826147521512368
  • Atomic Density: 0.08100276955117833
  • Unit Cell Volume: 222.21462426204363
  • Molar Volume: 7.434487479091876
  • Full Formula: V3 Cr3 Si12
  • Reduced Formula: VCrSi4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 3
  • Spacegroup Symbol: P121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -127.84814765
  • Final energy per atom: -7.102674869444445
  • 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.