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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-86662
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Y', 'Ni', 'B']
  • Chemical System: B-Ni-Y
  • Density: 7.535040963685305
  • Atomic Density: 0.07768911196297967
  • Unit Cell Volume: 231.69269856730168
  • Molar Volume: 7.751589132425227
  • Full Formula: Y3 Ni13 B2
  • Reduced Formula: Y3Ni13B2
  • Formula Anonymous: A2B3C13
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm