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-111043
  • 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: 4
  • Number of elements: 3
  • Element list: ['In', 'As', 'P']
  • Chemical System: As-In-P
  • Density: 4.993324606090051
  • Atomic Density: 0.035848218144970384
  • Unit Cell Volume: 111.58155710345153
  • Molar Volume: 16.798996077424075
  • Full Formula: In2 As1 P1
  • Reduced Formula: In2AsP
  • Formula Anonymous: ABC2
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m