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-15243
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Ce', 'B', 'N']
  • Chemical System: B-Ce-N
  • Density: 7.202889817463721
  • Atomic Density: 0.07839234054731796
  • Unit Cell Volume: 114.80713469152718
  • Molar Volume: 7.6820525040517325
  • Full Formula: Ce3 B2 N4
  • Reduced Formula: Ce3(BN2)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm