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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-106118
  • 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: 6
  • Number of elements: 3
  • Element list: ['Ca', 'U', 'O']
  • Chemical System: Ca-O-U
  • Density: 7.566106855141241
  • Atomic Density: 0.07991270358161748
  • Unit Cell Volume: 75.0819297944538
  • Molar Volume: 7.53589916257731
  • Full Formula: Ca1 U1 O4
  • Reduced Formula: CaUO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm