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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-20367
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 2
  • Element list: ['Zr', 'Mo']
  • Chemical System: Mo-Zr
  • Density: 8.538128482867492
  • Atomic Density: 0.054486490726265456
  • Unit Cell Volume: 110.11903905031038
  • Molar Volume: 11.052539225281764
  • Full Formula: Zr2 Mo4
  • Reduced Formula: ZrMo2
  • Formula Anonymous: AB2
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m