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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-90791
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Hf', 'Ti', 'F']
  • Chemical System: F-Hf-Ti
  • Density: 4.1189133021752875
  • Atomic Density: 0.058304366169868026
  • Unit Cell Volume: 137.21099337041483
  • Molar Volume: 10.328798948700813
  • Full Formula: Hf1 Ti1 F6
  • Reduced Formula: HfTiF6
  • Formula Anonymous: ABC6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m