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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-18514
  • 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: 9
  • Number of elements: 3
  • Element list: ['Zr', 'Co', 'As']
  • Chemical System: As-Co-Zr
  • Density: 7.1665854731251155
  • Atomic Density: 0.05137061254958038
  • Unit Cell Volume: 175.19744370020203
  • Molar Volume: 11.722929630608798
  • Full Formula: Zr6 Co1 As2
  • Reduced Formula: Zr6CoAs2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m