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-59643
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 2
  • Element list: ['Pd', 'F']
  • Chemical System: F-Pd
  • Density: 6.326472118892998
  • Atomic Density: 0.07914363967133523
  • Unit Cell Volume: 151.62304955689623
  • Molar Volume: 7.609127890767373
  • Full Formula: Pd4 F8
  • Reduced Formula: PdF2
  • Formula Anonymous: AB2
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3