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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117495
  • 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: 4
  • Number of elements: 2
  • Element list: ['B', 'I']
  • Chemical System: B-I
  • Density: 3.6300816063860566
  • Atomic Density: 0.022334099078520693
  • Unit Cell Volume: 179.09833684972358
  • Molar Volume: 26.96388485977326
  • Full Formula: B1 I3
  • Reduced Formula: BI3
  • Formula Anonymous: AB3
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m