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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-55252
  • 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: 24
  • Number of elements: 4
  • Element list: ['Na', 'Ca', 'Ta', 'O']
  • Chemical System: Ca-Na-O-Ta
  • Density: 4.577023139166966
  • Atomic Density: 0.07763091777125386
  • Unit Cell Volume: 309.1551753995496
  • Molar Volume: 7.757399928910736
  • Full Formula: Na6 Ca4 Ta2 O12
  • Reduced Formula: Na3Ca2TaO6
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 70
  • Spacegroup Symbol: Fddd1
  • Crystal System: orthorhombic
  • Pointgroup: mmm