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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-50484
  • 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: 14
  • Number of elements: 3
  • Element list: ['Ca', 'Y', 'O']
  • Chemical System: Ca-O-Y
  • Density: 4.700723054251131
  • Atomic Density: 0.07029721147913422
  • Unit Cell Volume: 199.15441459801735
  • Molar Volume: 8.566685126318994
  • Full Formula: Ca2 Y4 O8
  • Reduced Formula: CaY2O4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm