Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-95276
- 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: 12
- Number of elements: 3
- Element list: ['Ba', 'Zr', 'S']
- Chemical System: Ba-S-Zr
- Density: 4.201936670180396
- Atomic Density: 0.03708166836989384
- Unit Cell Volume: 323.61003502589585
- Molar Volume: 16.24020985228729
- Full Formula: Ba3 Zr2 S7
- Reduced Formula: Ba3Zr2S7
- Formula Anonymous: A2B3C7
- Spacegroup Number: 139
- Spacegroup Symbol: I4/mmm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
