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-16139
  • 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: 4
  • Number of elements: 2
  • Element list: ['Nb', 'P']
  • Chemical System: Nb-P
  • Density: 6.301725596275071
  • Atomic Density: 0.061268703719726245
  • Unit Cell Volume: 65.28618621177306
  • Molar Volume: 9.829065076271712
  • Full Formula: Nb2 P2
  • Reduced Formula: NbP
  • Formula Anonymous: AB
  • Spacegroup Number: 109
  • Spacegroup Symbol: I4_1md
  • Crystal System: tetragonal
  • Pointgroup: 4mm