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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98250
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 72
  • Number of elements: 5
  • Element list: ['In', 'H', 'C', 'N', 'O']
  • Chemical System: C-H-In-N-O
  • Density: 2.1187301081617353
  • Atomic Density: 0.08877957961907895
  • Unit Cell Volume: 810.9973071389383
  • Molar Volume: 6.78324991607172
  • Full Formula: In3 H24 C12 N3 O30
  • Reduced Formula: InH8C4NO10
  • Formula Anonymous: ABC4D8E10
  • Spacegroup Number: 180
  • Spacegroup Symbol: P6_222
  • Crystal System: hexagonal
  • Pointgroup: 622