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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111383
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['Ca', 'Sn', 'Hg']
  • Chemical System: Ca-Hg-Sn
  • Density: 7.489764347222576
  • Atomic Density: 0.03765206704956145
  • Unit Cell Volume: 79.67690050193254
  • Molar Volume: 15.99418367143841
  • Full Formula: Ca1 Sn1 Hg1
  • Reduced Formula: CaSnHg
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2