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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-107152
  • 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: 9
  • Number of elements: 3
  • Element list: ['Zr', 'P', 'Ru']
  • Chemical System: P-Ru-Zr
  • Density: 7.992739927154934
  • Atomic Density: 0.06467580158218234
  • Unit Cell Volume: 139.15560039196217
  • Molar Volume: 9.31127347891897
  • Full Formula: Zr3 P3 Ru3
  • Reduced Formula: ZrPRu
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m