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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-45228
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 26
  • Number of elements: 5
  • Element list: ['Na', 'Fe', 'P', 'C', 'O']
  • Chemical System: C-Fe-Na-O-P
  • Density: 3.000616653965526
  • Atomic Density: 0.08395865808127094
  • Unit Cell Volume: 309.67622153789455
  • Molar Volume: 7.1727453697159405
  • Full Formula: Na6 Fe2 P2 C2 O14
  • Reduced Formula: Na3FePCO7
  • Formula Anonymous: ABCD3E7
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m