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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91565
  • 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: 8
  • Number of elements: 2
  • Element list: ['Ca', 'O']
  • Chemical System: Ca-O
  • Density: 3.3343368129570354
  • Atomic Density: 0.07161475259486431
  • Unit Cell Volume: 111.70882688455592
  • Molar Volume: 8.409078495415852
  • Full Formula: Ca4 O4
  • Reduced Formula: CaO
  • Formula Anonymous: AB
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m