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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-53166
  • 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: 7
  • Number of elements: 3
  • Element list: ['Ca', 'In', 'Te']
  • Chemical System: Ca-In-Te
  • Density: 5.429893032859663
  • Atomic Density: 0.02934148870145534
  • Unit Cell Volume: 238.57003546152038
  • Molar Volume: 20.524319066678107
  • Full Formula: Ca1 In2 Te4
  • Reduced Formula: Ca(InTe2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 97
  • Spacegroup Symbol: I422
  • Crystal System: tetragonal
  • Pointgroup: 422