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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-74244
  • 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: ['Be', 'W', 'Cl']
  • Chemical System: Be-Cl-W
  • Density: 6.464978047932117
  • Atomic Density: 0.06562184438962781
  • Unit Cell Volume: 60.95531201851193
  • Molar Volume: 9.177036726129964
  • Full Formula: Be2 W1 Cl1
  • Reduced Formula: Be2WCl
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm