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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116997
  • 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: 25
  • Number of elements: 4
  • Element list: ['Zr', 'Ti', 'Pb', 'O']
  • Chemical System: O-Pb-Ti-Zr
  • Density: 7.772608563031685
  • Atomic Density: 0.07111922359031574
  • Unit Cell Volume: 351.5223977136364
  • Molar Volume: 8.467669437296884
  • Full Formula: Zr3 Ti2 Pb5 O15
  • Reduced Formula: Zr3Ti2(PbO3)5
  • Formula Anonymous: A2B3C5D15
  • Spacegroup Number: 35
  • Spacegroup Symbol: Cmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2