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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52216
  • 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: 23
  • Number of elements: 3
  • Element list: ['Sc', 'Cu', 'O']
  • Chemical System: Cu-O-Sc
  • Density: 4.6071683624255835
  • Atomic Density: 0.08502783218550665
  • Unit Cell Volume: 270.499663566872
  • Molar Volume: 7.082552389271074
  • Full Formula: Sc5 Cu5 O13
  • Reduced Formula: Sc5Cu5O13
  • Formula Anonymous: A5B5C13
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1