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-71073
  • 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: 4
  • Number of elements: 3
  • Element list: ['Be', 'Pd', 'Pt']
  • Chemical System: Be-Pd-Pt
  • Density: 15.504074862521097
  • Atomic Density: 0.07386684145453538
  • Unit Cell Volume: 54.151496412121226
  • Molar Volume: 8.152698343960724
  • Full Formula: Be1 Pd1 Pt2
  • Reduced Formula: BePdPt2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm