Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-99877
- 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: 10
- Number of elements: 3
- Element list: ['Ca', 'Tl', 'I']
- Chemical System: Ca-I-Tl
- Density: 5.2701486731878475
- Atomic Density: 0.02538296626476804
- Unit Cell Volume: 393.9649880037921
- Molar Volume: 23.72512612270547
- Full Formula: Ca2 Tl2 I6
- Reduced Formula: CaTlI3
- Formula Anonymous: ABC3
- Spacegroup Number: 63
- Spacegroup Symbol: Cmcm
- Crystal System: orthorhombic
- Pointgroup: mmm
