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-15432
  • 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: 9
  • Number of elements: 3
  • Element list: ['Si', 'Ni', 'B']
  • Chemical System: B-Ni-Si
  • Density: 7.405957343592334
  • Atomic Density: 0.09576636923626264
  • Unit Cell Volume: 93.97871164768021
  • Molar Volume: 6.28836699984202
  • Full Formula: Si2 Ni6 B1
  • Reduced Formula: Si2Ni6B
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m