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-63182
  • 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: 9
  • Number of elements: 3
  • Element list: ['Lu', 'As', 'Pd']
  • Chemical System: As-Lu-Pd
  • Density: 10.587636191008077
  • Atomic Density: 0.053683999330879244
  • Unit Cell Volume: 167.6477183551257
  • Molar Volume: 11.217757311415584
  • Full Formula: Lu3 As3 Pd3
  • Reduced Formula: LuAsPd
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m