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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-105867
  • 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: ['Th', 'Mg', 'Hg']
  • Chemical System: Hg-Mg-Th
  • Density: 10.989291779112545
  • Atomic Density: 0.04025961429817938
  • Unit Cell Volume: 99.35514956438338
  • Molar Volume: 14.958267397689236
  • Full Formula: Th1 Mg1 Hg2
  • Reduced Formula: ThMgHg2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m