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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-18400
  • 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: 2
  • Element list: ['Th', 'H']
  • Chemical System: H-Th
  • Density: 9.443613562959719
  • Atomic Density: 0.07289444071589891
  • Unit Cell Volume: 41.15540184596922
  • Molar Volume: 8.261454098359684
  • Full Formula: Th1 H2
  • Reduced Formula: ThH2
  • Formula Anonymous: AB2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm