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-11967
  • 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: 29
  • Number of elements: 2
  • Element list: ['Mg', 'Al']
  • Chemical System: Al-Mg
  • Density: 2.084509479017446
  • Atomic Density: 0.04939771016500617
  • Unit Cell Volume: 587.0717469115377
  • Molar Volume: 12.191133434897848
  • Full Formula: Mg17 Al12
  • Reduced Formula: Mg17Al12
  • Formula Anonymous: A12B17
  • Spacegroup Number: 217
  • Spacegroup Symbol: I-43m
  • Crystal System: cubic
  • Pointgroup: -43m