Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-69087
- 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: 4
- Number of elements: 3
- Element list: ['Ba', 'Ir', 'Cl']
- Chemical System: Ba-Cl-Ir
- Density: 5.841825103812068
- Atomic Density: 0.03514075972792153
- Unit Cell Volume: 113.82793175133747
- Molar Volume: 17.13719568565569
- Full Formula: Ba1 Ir1 Cl2
- Reduced Formula: BaIrCl2
- Formula Anonymous: ABC2
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm