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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103764
  • 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: 12
  • Number of elements: 3
  • Element list: ['H', 'C', 'F']
  • Chemical System: C-F-H
  • Density: 1.709353727037275
  • Atomic Density: 0.13414194680152533
  • Unit Cell Volume: 89.45747609996329
  • Molar Volume: 4.489379275902623
  • Full Formula: H6 C4 F2
  • Reduced Formula: H3C2F
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m