Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-98782
- 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: 23
- Number of elements: 5
- Element list: ['Ba', 'Nb', 'Ir', 'Cl', 'O']
- Chemical System: Ba-Cl-Ir-Nb-O
- Density: 5.224219834136885
- Atomic Density: 0.04939636623122574
- Unit Cell Volume: 465.6212947393007
- Molar Volume: 12.19146512075442
- Full Formula: Ba6 Nb2 Ir1 Cl2 O12
- Reduced Formula: Ba6Nb2Ir(ClO6)2
- Formula Anonymous: AB2C2D6E12
- Spacegroup Number: 164
- Spacegroup Symbol: P-3m1
- Crystal System: trigonal
- Pointgroup: -3m1
