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-4654
  • 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: 4
  • Number of elements: 2
  • Element list: ['Nb', 'P']
  • Chemical System: Nb-P
  • Density: 6.246805034571703
  • Atomic Density: 0.06073473701938093
  • Unit Cell Volume: 65.86016827114224
  • Molar Volume: 9.915480095152612
  • Full Formula: Nb2 P2
  • Reduced Formula: NbP
  • Formula Anonymous: AB
  • Spacegroup Number: 141
  • Spacegroup Symbol: I4_1/amd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm