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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-92985
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Zr', 'V', 'F']
  • Chemical System: F-V-Zr
  • Density: 3.120280459680502
  • Atomic Density: 0.058685407556624374
  • Unit Cell Volume: 136.32008932171019
  • Molar Volume: 10.261734578888897
  • Full Formula: Zr1 V1 F6
  • Reduced Formula: ZrVF6
  • Formula Anonymous: ABC6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m