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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-35181
  • 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: 12
  • Number of elements: 3
  • Element list: ['Zr', 'Si', 'O']
  • Chemical System: O-Si-Zr
  • Density: 5.161327119738428
  • Atomic Density: 0.10173824723934277
  • Unit Cell Volume: 117.94974186816471
  • Molar Volume: 5.9192495677979435
  • Full Formula: Zr2 Si2 O8
  • Reduced Formula: ZrSiO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 13
  • Spacegroup Symbol: P12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m