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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-55449
  • 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: 24
  • Number of elements: 4
  • Element list: ['Ba', 'Na', 'Ni', 'O']
  • Chemical System: Ba-Na-Ni-O
  • Density: 5.551102590148169
  • Atomic Density: 0.07041248230223443
  • Unit Cell Volume: 340.8486565916509
  • Molar Volume: 8.552660782715932
  • Full Formula: Ba4 Na2 Ni6 O12
  • Reduced Formula: Ba2Na(NiO2)3
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 69
  • Spacegroup Symbol: Fmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm