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-122142
  • 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: 13
  • Number of elements: 4
  • Element list: ['Zr', 'Mn', 'Ga', 'Sn']
  • Chemical System: Ga-Mn-Sn-Zr
  • Density: 7.9327025374994475
  • Atomic Density: 0.05999527647248683
  • Unit Cell Volume: 216.68372519229337
  • Molar Volume: 10.037691488531916
  • Full Formula: Zr1 Mn6 Ga2 Sn4
  • Reduced Formula: ZrMn6(GaSn2)2
  • Formula Anonymous: AB2C4D6
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm