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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100628
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Pu', 'Te', 'O']
  • Chemical System: O-Pu-Te
  • Density: 10.903646349636936
  • Atomic Density: 0.05069750989151435
  • Unit Cell Volume: 98.624173272007
  • Molar Volume: 11.878573075653117
  • Full Formula: Pu2 Te1 O2
  • Reduced Formula: Pu2TeO2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm