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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-68772
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ti', 'Be', 'Hg']
  • Chemical System: Be-Hg-Ti
  • Density: 7.955363012092127
  • Atomic Density: 0.0719124446875354
  • Unit Cell Volume: 55.62319592082122
  • Molar Volume: 8.37426788390608
  • Full Formula: Ti1 Be2 Hg1
  • Reduced Formula: TiBe2Hg
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm