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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-75447
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Tc', 'As', 'Cl']
  • Chemical System: As-Cl-Tc
  • Density: 7.987430705141152
  • Atomic Density: 0.06280080924949903
  • Unit Cell Volume: 63.69344675334592
  • Molar Volume: 9.589272545955353
  • Full Formula: Tc2 As1 Cl1
  • Reduced Formula: Tc2AsCl
  • Formula Anonymous: ABC2
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m