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-89004
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 30
  • Number of elements: 3
  • Element list: ['Y', 'Ga', 'O']
  • Chemical System: Ga-O-Y
  • Density: 5.462738935699611
  • Atomic Density: 0.07960570219940778
  • Unit Cell Volume: 376.8574256760112
  • Molar Volume: 7.564961546240592
  • Full Formula: Y6 Ga6 O18
  • Reduced Formula: YGaO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 185
  • Spacegroup Symbol: P6_3cm
  • Crystal System: hexagonal
  • Pointgroup: 6mm