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-79012
  • 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: ['La', 'Pd', 'Ru']
  • Chemical System: La-Pd-Ru
  • Density: 8.513962992093383
  • Atomic Density: 0.04226019721415394
  • Unit Cell Volume: 94.65171162666287
  • Molar Volume: 14.25014826476731
  • Full Formula: La2 Pd1 Ru1
  • Reduced Formula: La2PdRu
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m