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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35097
  • 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: 6
  • Number of elements: 3
  • Element list: ['Th', 'H', 'N']
  • Chemical System: H-N-Th
  • Density: 9.747643815470493
  • Atomic Density: 0.06945517838630172
  • Unit Cell Volume: 86.38664732280564
  • Molar Volume: 8.670542499373546
  • Full Formula: Th2 H1 N3
  • Reduced Formula: Th2HN3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1