Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-50344
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 22
- Number of elements: 3
- Element list: ['Ba', 'Hf', 'O']
- Chemical System: Ba-Hf-O
- Density: 6.684056899272103
- Atomic Density: 0.053748319556546756
- Unit Cell Volume: 409.3151224356802
- Molar Volume: 11.204333102292274
- Full Formula: Ba8 Hf2 O12
- Reduced Formula: Ba4HfO6
- Formula Anonymous: AB4C6
- Spacegroup Number: 167
- Spacegroup Symbol: R-3cH
- Crystal System: trigonal
- Pointgroup: -3m