Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-101234
- 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: 4
- Element list: ['Ba', 'I', 'Br', 'F']
- Chemical System: Ba-Br-F-I
- Density: 5.194834790773366
- Atomic Density: 0.03613452807611863
- Unit Cell Volume: 166.0461702270137
- Molar Volume: 16.66589016276663
- Full Formula: Ba2 I1 Br1 F2
- Reduced Formula: Ba2IBrF2
- Formula Anonymous: ABC2D2
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm
