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-67927
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Sc', 'Be', 'Os']
  • Chemical System: Be-Os-Sc
  • Density: 7.554873925413393
  • Atomic Density: 0.06293741504465383
  • Unit Cell Volume: 63.555199989736096
  • Molar Volume: 9.568459009203533
  • Full Formula: Sc2 Be1 Os1
  • Reduced Formula: Sc2BeOs
  • Formula Anonymous: ABC2
  • Spacegroup Number: 119
  • Spacegroup Symbol: I-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2