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-70940
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Be', 'Zn', 'Ga']
  • Chemical System: Be-Ga-Zn
  • Density: 6.110114171026726
  • Atomic Density: 0.0702370009543631
  • Unit Cell Volume: 56.95003980308076
  • Molar Volume: 8.574028899543876
  • Full Formula: Be1 Zn2 Ga1
  • Reduced Formula: BeZn2Ga
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm