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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-644587
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 54
  • Number of elements: 7
  • Element list: ['C', 'H', 'Ho', 'K', 'N', 'O', 'Ru']
  • Chemical System: C-H-Ho-K-N-O-Ru
  • Density: 2.734348294756803
  • Atomic Density: 0.08337313263492888
  • Unit Cell Volume: 647.6906683649895
  • Molar Volume: 7.223119210800825
  • Full Formula: K2 Ho2 H16 Ru2 C12 N12 O8
  • Reduced Formula: KHoH8RuC6(N3O2)2
  • Formula Anonymous: ABCD4E6F6G8
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm