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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-95247
  • 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: 40
  • Number of elements: 3
  • Element list: ['Li', 'H', 'Ir']
  • Chemical System: H-Ir-Li
  • Density: 4.256301604144274
  • Atomic Density: 0.11699449309887358
  • Unit Cell Volume: 341.896434101351
  • Molar Volume: 5.147371128751
  • Full Formula: Li12 H24 Ir4
  • Reduced Formula: Li3H6Ir
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1