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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12332
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Zr', 'Ni', 'Sb']
  • Chemical System: Ni-Sb-Zr
  • Density: 8.292539596732162
  • Atomic Density: 0.05514500734325253
  • Unit Cell Volume: 217.6080950593672
  • Molar Volume: 10.920554824691415
  • Full Formula: Zr4 Ni4 Sb4
  • Reduced Formula: ZrNiSb
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm