Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109807
  • 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: 5
  • Number of elements: 3
  • Element list: ['Co', 'Ni', 'N']
  • Chemical System: Co-N-Ni
  • Density: 7.484021084851297
  • Atomic Density: 0.11015575510984013
  • Unit Cell Volume: 45.390274843237435
  • Molar Volume: 5.466932484821256
  • Full Formula: Co2 Ni1 N2
  • Reduced Formula: Co2NiN2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm