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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-80690
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Ca', 'Zn', 'Ga']
  • Chemical System: Ca-Ga-Zn
  • Density: 3.6868865888537723
  • Atomic Density: 0.041252554739523856
  • Unit Cell Volume: 96.96369170968268
  • Molar Volume: 14.598225002123854
  • Full Formula: Ca2 Zn1 Ga1
  • Reduced Formula: Ca2ZnGa
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m