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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111634
  • 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: ['Na', 'V', 'F']
  • Chemical System: F-Na-V
  • Density: 3.535453721447347
  • Atomic Density: 0.08130899169714031
  • Unit Cell Volume: 245.97525541204578
  • Molar Volume: 7.406488057841457
  • Full Formula: Na4 V4 F12
  • Reduced Formula: NaVF3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm