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-104661
  • 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: 10
  • Number of elements: 4
  • Element list: ['Sr', 'Fe', 'Ir', 'O']
  • Chemical System: Fe-Ir-O-Sr
  • Density: 7.036751358041168
  • Atomic Density: 0.08160299971247632
  • Unit Cell Volume: 122.54451472659643
  • Molar Volume: 7.379803170494566
  • Full Formula: Sr2 Fe1 Ir1 O6
  • Reduced Formula: Sr2FeIrO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 87
  • Spacegroup Symbol: I4/m
  • Crystal System: tetragonal
  • Pointgroup: 4/m