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-67012
  • 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: 3
  • Number of elements: 3
  • Element list: ['Sr', 'Ta', 'Be']
  • Chemical System: Be-Sr-Ta
  • Density: 7.590193095902876
  • Atomic Density: 0.0494011106981849
  • Unit Cell Volume: 60.72737955890183
  • Molar Volume: 12.190294256321785
  • Full Formula: Sr1 Ta1 Be1
  • Reduced Formula: SrTaBe
  • Formula Anonymous: ABC
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm