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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-16317
  • 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: 5
  • Number of elements: 3
  • Element list: ['Zr', 'Ru', 'C']
  • Chemical System: C-Ru-Zr
  • Density: 9.818692693669439
  • Atomic Density: 0.07273996868564757
  • Unit Cell Volume: 68.73800044660395
  • Molar Volume: 8.278998285007836
  • Full Formula: Zr1 Ru3 C1
  • Reduced Formula: ZrRu3C
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m