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: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-679823
  • Created at: Sept. 4, 2022, 3:16 p.m.
  • Last updated at: Sept. 4, 2022, 3:16 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Ag', 'O', 'Pa']
  • Chemical System: Ag-O-Pa
  • Density: 14.126293447240984
  • Atomic Density: 0.10993800241465285
  • Unit Cell Volume: 45.48017873875418
  • Molar Volume: 5.4777607630947385
  • Full Formula: Pa1 Ag1 O3
  • Reduced Formula: PaAgO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm