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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-86517
  • 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: 14
  • Number of elements: 3
  • Element list: ['Ca', 'Pt', 'O']
  • Chemical System: Ca-O-Pt
  • Density: 8.743835796714013
  • Atomic Density: 0.07457785387172414
  • Unit Cell Volume: 187.72328879402144
  • Molar Volume: 8.074971921769484
  • Full Formula: Ca2 Pt4 O8
  • Reduced Formula: Ca(PtO2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 131
  • Spacegroup Symbol: P4_2/mmc
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm