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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-25668
  • 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: 44
  • Number of elements: 4
  • Element list: ['Tl', 'In', 'As', 'O']
  • Chemical System: As-In-O-Tl
  • Density: 5.535808150136364
  • Atomic Density: 0.0631129329638526
  • Unit Cell Volume: 697.1629733195988
  • Molar Volume: 9.541848995433519
  • Full Formula: Tl4 In4 As8 O28
  • Reduced Formula: TlInAs2O7
  • Formula Anonymous: ABC2D7
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1