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-2199
  • 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: 8
  • Number of elements: 3
  • Element list: ['Mg', 'Si', 'P']
  • Chemical System: Mg-P-Si
  • Density: 2.2350370784811555
  • Atomic Density: 0.04708742524738427
  • Unit Cell Volume: 169.89673905443374
  • Molar Volume: 12.789275965634866
  • Full Formula: Mg2 Si2 P4
  • Reduced Formula: MgSiP2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 122
  • Spacegroup Symbol: I-42d
  • Crystal System: tetragonal
  • Pointgroup: -42m