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-18702
  • 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: 2
  • Element list: ['Fe', 'Pd']
  • Chemical System: Fe-Pd
  • Density: 9.870895393123597
  • Atomic Density: 0.08679370189289248
  • Unit Cell Volume: 46.086293276627245
  • Molar Volume: 6.938453630462273
  • Full Formula: Fe3 Pd1
  • Reduced Formula: Fe3Pd
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m