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-64755
  • 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: 6
  • Number of elements: 3
  • Element list: ['Ba', 'Ga', 'Te']
  • Chemical System: Ba-Ga-Te
  • Density: 5.006112128156474
  • Atomic Density: 0.024226836474659997
  • Unit Cell Volume: 247.65924375952616
  • Molar Volume: 24.85731377391697
  • Full Formula: Ba4 Ga1 Te1
  • Reduced Formula: Ba4GaTe
  • Formula Anonymous: ABC4
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m