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-17533
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Ce', 'Mg', 'Si']
  • Chemical System: Ce-Mg-Si
  • Density: 3.9385107836078137
  • Atomic Density: 0.048424983425400636
  • Unit Cell Volume: 103.25248758634207
  • Molar Volume: 12.43602028130209
  • Full Formula: Ce1 Mg2 Si2
  • Reduced Formula: Ce(MgSi)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm