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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35507
  • 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: 7
  • Number of elements: 4
  • Element list: ['Ce', 'C', 'N', 'O']
  • Chemical System: C-Ce-N-O
  • Density: 5.370904292158971
  • Atomic Density: 0.06427458969891661
  • Unit Cell Volume: 108.90773527750719
  • Molar Volume: 9.369395881342372
  • Full Formula: Ce2 C1 N2 O2
  • Reduced Formula: Ce2C(NO)2
  • Formula Anonymous: AB2C2D2
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1