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-13020
  • 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: 10
  • Number of elements: 3
  • Element list: ['Cu', 'Pb', 'O']
  • Chemical System: Cu-O-Pb
  • Density: 7.853263335883544
  • Atomic Density: 0.06455725512404553
  • Unit Cell Volume: 154.90125750831865
  • Molar Volume: 9.328371766161016
  • Full Formula: Cu4 Pb2 O4
  • Reduced Formula: Cu2PbO2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m