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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98227
  • 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: 24
  • Number of elements: 3
  • Element list: ['Ca', 'Ru', 'O']
  • Chemical System: Ca-O-Ru
  • Density: 4.90752669245554
  • Atomic Density: 0.08164605330012627
  • Unit Cell Volume: 293.9517469604729
  • Molar Volume: 7.375911653516125
  • Full Formula: Ca6 Ru4 O14
  • Reduced Formula: Ca3Ru2O7
  • Formula Anonymous: A2B3C7
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2