Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-32398
- 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: 4
- Element list: ['B', 'C', 'Cl', 'O']
- Chemical System: B-C-Cl-O
- Density: 1.8774753068783825
- Atomic Density: 0.047778301778321486
- Unit Cell Volume: 251.16003611172252
- Molar Volume: 12.604342422928967
- Full Formula: B4 C1 Cl6 O1
- Reduced Formula: B4CCl6O
- Formula Anonymous: ABC4D6
- Spacegroup Number: 160
- Spacegroup Symbol: R3mH
- Crystal System: trigonal
- Pointgroup: 3m
