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-106174
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ni', 'Sb', 'Te']
  • Chemical System: Ni-Sb-Te
  • Density: 8.32561081613002
  • Atomic Density: 0.05468404933871552
  • Unit Cell Volume: 73.14747258791711
  • Molar Volume: 11.012609404066959
  • Full Formula: Ni2 Sb1 Te1
  • Reduced Formula: Ni2SbTe
  • Formula Anonymous: ABC2
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2