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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-106880
  • 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: 9
  • Number of elements: 3
  • Element list: ['Ca', 'V', 'O']
  • Chemical System: Ca-O-V
  • Density: 3.203711206311472
  • Atomic Density: 0.07297053952059471
  • Unit Cell Volume: 123.33744630543538
  • Molar Volume: 8.25283847366971
  • Full Formula: Ca1 V2 O6
  • Reduced Formula: CaV2O6
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m