Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-117876
- 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: 6
- Number of elements: 3
- Element list: ['C', 'N', 'Cl']
- Chemical System: C-Cl-N
- Density: 1.7868782088197677
- Atomic Density: 0.05251714043608645
- Unit Cell Volume: 114.24841394976602
- Molar Volume: 11.46700050687064
- Full Formula: C2 N2 Cl2
- Reduced Formula: CNCl
- Formula Anonymous: ABC
- Spacegroup Number: 59
- Spacegroup Symbol: Pmmn1
- Crystal System: orthorhombic
- Pointgroup: mmm
