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-119984
  • 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: 3
  • Number of elements: 2
  • Element list: ['Mg', 'Be']
  • Chemical System: Be-Mg
  • Density: 1.5344401573885917
  • Atomic Density: 0.048109673903622814
  • Unit Cell Volume: 62.35752098444571
  • Molar Volume: 12.517525627099529
  • Full Formula: Mg2 Be1
  • Reduced Formula: Mg2Be
  • Formula Anonymous: AB2
  • Spacegroup Number: 47
  • Spacegroup Symbol: Pmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm