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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23372
  • 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: ['Ca', 'In', 'Pd']
  • Chemical System: Ca-In-Pd
  • Density: 6.925003419603155
  • Atomic Density: 0.04130611820071314
  • Unit Cell Volume: 290.5138638709658
  • Molar Volume: 14.57929484135362
  • Full Formula: Ca2 In8 Pd2
  • Reduced Formula: CaIn4Pd
  • Formula Anonymous: ABC4
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm