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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117139
  • 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: 20
  • Number of elements: 3
  • Element list: ['Nb', 'B', 'Ru']
  • Chemical System: B-Nb-Ru
  • Density: 9.8744490997412
  • Atomic Density: 0.07380659842758944
  • Unit Cell Volume: 270.97848195269023
  • Molar Volume: 8.1593528062511
  • Full Formula: Nb6 B4 Ru10
  • Reduced Formula: Nb3B2Ru5
  • Formula Anonymous: A2B3C5
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm