Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-2700
- 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: ['Th', 'Se', 'O']
- Chemical System: O-Se-Th
- Density: 9.372918115329096
- Atomic Density: 0.05178483549258021
- Unit Cell Volume: 115.86403515484156
- Molar Volume: 11.629158812067404
- Full Formula: Th2 Se2 O2
- Reduced Formula: ThSeO
- Formula Anonymous: ABC
- Spacegroup Number: 129
- Spacegroup Symbol: P4/nmm1
- Crystal System: tetragonal
- Pointgroup: 4/mmm