Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-117874
- 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: 3
- Number of elements: 3
- Element list: ['C', 'N', 'Cl']
- Chemical System: C-Cl-N
- Density: 0.9363114410488281
- Atomic Density: 0.027518607143322948
- Unit Cell Volume: 109.01714553993745
- Molar Volume: 21.883886523163653
- Full Formula: C1 N1 Cl1
- Reduced Formula: CNCl
- Formula Anonymous: ABC
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm
