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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-74667
  • 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: 5
  • Number of elements: 3
  • Element list: ['Mn', 'Be', 'Cl']
  • Chemical System: Be-Cl-Mn
  • Density: 3.2246696278451537
  • Atomic Density: 0.06749019657988732
  • Unit Cell Volume: 74.08483384815098
  • Molar Volume: 8.922985952295553
  • Full Formula: Mn1 Be2 Cl2
  • Reduced Formula: Mn(BeCl)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm