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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-94420
  • 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: 6
  • Number of elements: 2
  • Element list: ['Fe', 'B']
  • Chemical System: B-Fe
  • Density: 7.589266174793313
  • Atomic Density: 0.11192634146375856
  • Unit Cell Volume: 53.60668383807384
  • Molar Volume: 5.380449929161628
  • Full Formula: Fe4 B2
  • Reduced Formula: Fe2B
  • Formula Anonymous: AB2
  • Spacegroup Number: 140
  • Spacegroup Symbol: I4/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm