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-123904
  • 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: 2
  • Number of elements: 2
  • Element list: ['Mg', 'B']
  • Chemical System: B-Mg
  • Density: 2.1355192316046843
  • Atomic Density: 0.07324522959821578
  • Unit Cell Volume: 27.305532537353383
  • Molar Volume: 8.2218880233351
  • Full Formula: Mg1 B1
  • Reduced Formula: MgB
  • Formula Anonymous: AB
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2