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-36752
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Cu', 'Pt', 'O']
  • Chemical System: Cu-O-Pt
  • Density: 9.855143655257692
  • Atomic Density: 0.08168366290263387
  • Unit Cell Volume: 48.96940046344348
  • Molar Volume: 7.372515563091646
  • Full Formula: Cu1 Pt1 O2
  • Reduced Formula: CuPtO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 47
  • Spacegroup Symbol: Pmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm