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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-30521
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ni', 'H', 'O']
  • Chemical System: H-Ni-O
  • Density: 4.577123221811
  • Atomic Density: 0.12023571753384937
  • Unit Cell Volume: 33.26798460593791
  • Molar Volume: 5.008612152461781
  • Full Formula: Ni1 H1 O2
  • Reduced Formula: NiHO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1