Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: oqmd-20647
  • Created at: Sept. 4, 2022, 2:49 p.m.
  • Last updated at: Sept. 4, 2022, 2:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 152
  • Number of elements: 4
  • Element list: ['C', 'H', 'N', 'Si']
  • Chemical System: C-H-N-Si
  • Density: 1.192973020450196
  • Atomic Density: 0.12669273301659442
  • Unit Cell Volume: 1199.7531064397417
  • Molar Volume: 4.753343476465386
  • Full Formula: Si8 H100 C40 N4
  • Reduced Formula: Si2H25C10N
  • Formula Anonymous: AB2C10D25
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m