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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-108175
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Ca', 'Ru', 'N']
  • Chemical System: Ca-N-Ru
  • Density: 7.166504891460569
  • Atomic Density: 0.0798532317645515
  • Unit Cell Volume: 62.614873431078884
  • Molar Volume: 7.541511629430825
  • Full Formula: Ca1 Ru2 N2
  • Reduced Formula: Ca(RuN)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1