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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-120706
  • 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: 15
  • Number of elements: 4
  • Element list: ['Ba', 'Re', 'N', 'O']
  • Chemical System: Ba-N-O-Re
  • Density: 6.409542593981288
  • Atomic Density: 0.04466064091041859
  • Unit Cell Volume: 335.8662055497002
  • Molar Volume: 13.484223775649253
  • Full Formula: Ba6 Re2 N6 O1
  • Reduced Formula: Ba6Re2N6O
  • Formula Anonymous: AB2C6D6
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3