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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-88546
  • 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: 18
  • Number of elements: 3
  • Element list: ['Ba', 'In', 'P']
  • Chemical System: Ba-In-P
  • Density: 4.607074059135851
  • Atomic Density: 0.03261869450930404
  • Unit Cell Volume: 551.8307912312598
  • Molar Volume: 18.46223722498234
  • Full Formula: Ba6 In4 P8
  • Reduced Formula: Ba3(InP2)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m