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: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-22824
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 40
  • Number of elements: 3
  • Element list: ['Sm', 'Si', 'N']
  • Chemical System: N-Si-Sm
  • Density: 5.195819112586061
  • Atomic Density: 0.08088742625294505
  • Unit Cell Volume: 494.5144363342087
  • Molar Volume: 7.4450888586416575
  • Full Formula: Sm6 Si12 N22
  • Reduced Formula: Sm3Si6N11
  • Formula Anonymous: A3B6C11
  • Spacegroup Number: 100
  • Spacegroup Symbol: P4bm
  • Crystal System: tetragonal
  • Pointgroup: 4mm