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-16026
  • 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: 6
  • Number of elements: 3
  • Element list: ['Sr', 'Pu', 'O']
  • Chemical System: O-Pu-Sr
  • Density: 7.952308193229831
  • Atomic Density: 0.07263062005797678
  • Unit Cell Volume: 82.6097862748597
  • Molar Volume: 8.291462685012018
  • Full Formula: Sr1 Pu1 O4
  • Reduced Formula: SrPuO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m