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-115123
  • 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: 6
  • Number of elements: 3
  • Element list: ['Al', 'Ge', 'H']
  • Chemical System: Al-Ge-H
  • Density: 4.16028272700143
  • Atomic Density: 0.07469125908416657
  • Unit Cell Volume: 80.33068492310247
  • Molar Volume: 8.062711532568882
  • Full Formula: Al2 Ge2 H2
  • Reduced Formula: AlGeH
  • Formula Anonymous: ABC
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm