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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-3355
  • Created at: Sept. 4, 2022, 2:55 p.m.
  • Last updated at: Sept. 4, 2022, 2:55 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 112
  • Number of elements: 3
  • Element list: ['H', 'Mg', 'N']
  • Chemical System: H-Mg-N
  • Density: 1.5195467242394016
  • Atomic Density: 0.11367575509191565
  • Unit Cell Volume: 985.2584652676319
  • Molar Volume: 5.297647466806475
  • Full Formula: Mg16 H64 N32
  • Reduced Formula: Mg(H2N)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 142
  • Spacegroup Symbol: I4_1/acd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm