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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23344
  • 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: 10
  • Number of elements: 3
  • Element list: ['Zr', 'In', 'Ni']
  • Chemical System: In-Ni-Zr
  • Density: 7.9428701743511665
  • Atomic Density: 0.057678474913082166
  • Unit Cell Volume: 173.3749031171398
  • Molar Volume: 10.44088070822779
  • Full Formula: Zr4 In2 Ni4
  • Reduced Formula: Zr2InNi2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm