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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-96812
  • 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: 28
  • Number of elements: 6
  • Element list: ['Si', 'H', 'C', 'N', 'Cl', 'O']
  • Chemical System: C-Cl-H-N-O-Si
  • Density: 1.4300749956213086
  • Atomic Density: 0.09597233272522009
  • Unit Cell Volume: 291.7507494599224
  • Molar Volume: 6.274871714582667
  • Full Formula: Si2 H16 C4 N2 Cl2 O2
  • Reduced Formula: SiH8C2NClO
  • Formula Anonymous: ABCDE2F8
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1