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: ['mineral_name', 'aflow_id', 'pearson_symbol', 'strukturbericht_symbol', 'nsites_wyckoff']

Base Information:

  • Database Entry ID: 271
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: AFLOW Prototypes

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['O', 'Pb', 'Zr']
  • Chemical System: O-Pb-Zr
  • Density: 8.513591992820736
  • Atomic Density: 0.07399937038055472
  • Unit Cell Volume: 67.56814246238345
  • Molar Volume: 8.138097296004123
  • Full Formula: Zr1 Pb1 O3
  • Reduced Formula: ZrPbO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m