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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-90166
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 4
  • Element list: ['Ca', 'U', 'P', 'O']
  • Chemical System: Ca-O-P-U
  • Density: 4.5447378751111005
  • Atomic Density: 0.03836299195575014
  • Unit Cell Volume: 234.60109707764886
  • Molar Volume: 15.697786989466955
  • Full Formula: Ca1 U2 P2 O4
  • Reduced Formula: CaU2(PO2)2
  • Formula Anonymous: AB2C2D4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm