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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97661
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 36
  • Number of elements: 6
  • Element list: ['Si', 'B', 'H', 'C', 'N', 'Cl']
  • Chemical System: B-C-Cl-H-N-Si
  • Density: 2.090213003890476
  • Atomic Density: 0.07043117666545877
  • Unit Cell Volume: 511.13727903477314
  • Molar Volume: 8.550390672307781
  • Full Formula: Si4 B4 H4 C12 N4 Cl8
  • Reduced Formula: SiBHC3NCl2
  • Formula Anonymous: ABCDE2F3
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m