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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102805
  • 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: 6
  • Number of elements: 3
  • Element list: ['B', 'Mo', 'Ir']
  • Chemical System: B-Ir-Mo
  • Density: 9.66031792589191
  • Atomic Density: 0.10532701052110882
  • Unit Cell Volume: 56.96544476402401
  • Molar Volume: 5.7175654470826265
  • Full Formula: B4 Mo1 Ir1
  • Reduced Formula: B4MoIr
  • Formula Anonymous: ABC4
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2