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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-51187
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Ca', 'Ta', 'Tl']
  • Chemical System: Ca-Ta-Tl
  • Density: 11.814069682631557
  • Atomic Density: 0.04693339637331332
  • Unit Cell Volume: 85.2271582517397
  • Molar Volume: 12.8312485891693
  • Full Formula: Ca1 Ta2 Tl1
  • Reduced Formula: CaTa2Tl
  • Formula Anonymous: ABC2
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m