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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102460
  • 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: ['Ca', 'Tl', 'Zn']
  • Chemical System: Ca-Tl-Zn
  • Density: 5.4865572862844685
  • Atomic Density: 0.037766516113639514
  • Unit Cell Volume: 105.91392618699572
  • Molar Volume: 15.945714298558459
  • Full Formula: Ca2 Tl1 Zn1
  • Reduced Formula: Ca2TlZn
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m