Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-51701
- 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: 20
- Number of elements: 4
- Element list: ['Ba', 'H', 'Cl', 'O']
- Chemical System: Ba-Cl-H-O
- Density: 3.1815282962318525
- Atomic Density: 0.08484540525109986
- Unit Cell Volume: 235.72284133489643
- Molar Volume: 7.097780654329463
- Full Formula: Ba2 H10 Cl2 O6
- Reduced Formula: BaH5ClO3
- Formula Anonymous: ABC3D5
- Spacegroup Number: 129
- Spacegroup Symbol: P4/nmm1
- Crystal System: tetragonal
- Pointgroup: 4/mmm
