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-115096
  • 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: ['Al', 'Ga', 'O']
  • Chemical System: Al-Ga-O
  • Density: 4.2130939454485175
  • Atomic Density: 0.0788537269020392
  • Unit Cell Volume: 50.72683507996066
  • Molar Volume: 7.637103529020724
  • Full Formula: Al1 Ga1 O2
  • Reduced Formula: AlGaO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm