Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-50666
- Created at: Sept. 4, 2022, 2:37 p.m.
- Last updated at: Sept. 4, 2022, 2:37 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 17
- Number of elements: 3
- Element list: ['Th', 'Nb', 'O']
- Chemical System: Nb-O-Th
- Density: 5.263187118806424
- Atomic Density: 0.06772095671156636
- Unit Cell Volume: 251.03012162698073
- Molar Volume: 8.892580749632929
- Full Formula: Th1 Nb4 O12
- Reduced Formula: ThNb4O12
- Formula Anonymous: AB4C12
- Spacegroup Number: 139
- Spacegroup Symbol: I4/mmm
- Crystal System: tetragonal
- Pointgroup: 4/mmm