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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-21679
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 11
  • Number of elements: 3
  • Element list: ['Ca', 'Ga', 'Ni']
  • Chemical System: Ca-Ga-Ni
  • Density: 5.24545327290196
  • Atomic Density: 0.0548158474423524
  • Unit Cell Volume: 200.67189532312264
  • Molar Volume: 10.98613091101664
  • Full Formula: Ca3 Ga4 Ni4
  • Reduced Formula: Ca3(GaNi)4
  • Formula Anonymous: A3B4C4
  • Spacegroup Number: 217
  • Spacegroup Symbol: I-43m
  • Crystal System: cubic
  • Pointgroup: -43m