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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-7696
  • 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: 9
  • Number of elements: 4
  • Element list: ['Na', 'Cu', 'S', 'O']
  • Chemical System: Cu-Na-O-S
  • Density: 2.3901507609835533
  • Atomic Density: 0.05340746283416943
  • Unit Cell Volume: 168.51577518192667
  • Molar Volume: 11.275841315845302
  • Full Formula: Na5 Cu1 S1 O2
  • Reduced Formula: Na5CuSO2
  • Formula Anonymous: ABC2D5
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm