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-116213
  • 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: 3
  • Number of elements: 2
  • Element list: ['P', 'Ir']
  • Chemical System: Ir-P
  • Density: 8.01813079870313
  • Atomic Density: 0.05699416058383685
  • Unit Cell Volume: 52.63697138914928
  • Molar Volume: 10.56624169618499
  • Full Formula: P2 Ir1
  • Reduced Formula: P2Ir
  • Formula Anonymous: AB2
  • Spacegroup Number: 47
  • Spacegroup Symbol: Pmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm