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-27287
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 22
  • Number of elements: 2
  • Element list: ['Nb', 'Se']
  • Chemical System: Nb-Se
  • Density: 5.142230265517087
  • Atomic Density: 0.03799860902762512
  • Unit Cell Volume: 578.9685612967023
  • Molar Volume: 15.848318962470135
  • Full Formula: Nb4 Se18
  • Reduced Formula: Nb2Se9
  • Formula Anonymous: A2B9
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1