Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-117791
- Created at: Sept. 4, 2022, 2:38 p.m.
- Last updated at: Sept. 4, 2022, 2:38 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 3
- Number of elements: 2
- Element list: ['I', 'Br']
- Chemical System: Br-I
- Density: 4.481157212535677
- Atomic Density: 0.02425991588240923
- Unit Cell Volume: 123.66077502252547
- Molar Volume: 24.823419789211357
- Full Formula: I2 Br1
- Reduced Formula: I2Br
- Formula Anonymous: AB2
- Spacegroup Number: 123
- Spacegroup Symbol: P4/mmm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
