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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-74600
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Mn', 'Be', 'Cl']
  • Chemical System: Be-Cl-Mn
  • Density: 3.0188933623567156
  • Atomic Density: 0.06707607688432744
  • Unit Cell Volume: 59.6337798183694
  • Molar Volume: 8.978075402926693
  • Full Formula: Mn1 Be2 Cl1
  • Reduced Formula: MnBe2Cl
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm