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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-46695
  • 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: 20
  • Number of elements: 3
  • Element list: ['V', 'O', 'F']
  • Chemical System: F-O-V
  • Density: 3.3256396331995535
  • Atomic Density: 0.08079755795030841
  • Unit Cell Volume: 247.53223373781015
  • Molar Volume: 7.453369771031569
  • Full Formula: V4 O4 F12
  • Reduced Formula: VOF3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 76
  • Spacegroup Symbol: P4_1
  • Crystal System: tetragonal
  • Pointgroup: 4