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-92589
  • 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: 5
  • Number of elements: 3
  • Element list: ['Pr', 'Fe', 'Ge']
  • Chemical System: Fe-Ge-Pr
  • Density: 7.283363489117757
  • Atomic Density: 0.05288682549098601
  • Unit Cell Volume: 94.54150355180983
  • Molar Volume: 11.386844841020775
  • Full Formula: Pr1 Fe1 Ge3
  • Reduced Formula: PrFeGe3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm