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-67314
  • 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: ['Y', 'Be', 'Zn']
  • Chemical System: Be-Y-Zn
  • Density: 5.165941846756747
  • Atomic Density: 0.05714307409301562
  • Unit Cell Volume: 52.49980067779865
  • Molar Volume: 10.538706318454897
  • Full Formula: Y1 Be1 Zn1
  • Reduced Formula: YBeZn
  • Formula Anonymous: ABC
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm