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-57801
  • 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: 18
  • Number of elements: 3
  • Element list: ['Nd', 'Co', 'B']
  • Chemical System: B-Co-Nd
  • Density: 8.430852923140042
  • Atomic Density: 0.08129011968007316
  • Unit Cell Volume: 221.42912411546595
  • Molar Volume: 7.408207521038037
  • Full Formula: Nd3 Co11 B4
  • Reduced Formula: Nd3Co11B4
  • Formula Anonymous: A3B4C11
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm