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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-81952
  • 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: 4
  • Number of elements: 3
  • Element list: ['Hf', 'Sc', 'Tl']
  • Chemical System: Hf-Sc-Tl
  • Density: 9.688634653765096
  • Atomic Density: 0.03691563869419307
  • Unit Cell Volume: 108.35516170086503
  • Molar Volume: 16.313250895879253
  • Full Formula: Hf1 Sc1 Tl2
  • Reduced Formula: HfScTl2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm