Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-14343
- 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: 6
- Number of elements: 3
- Element list: ['C', 'N', 'Cl']
- Chemical System: C-Cl-N
- Density: 1.760603146759912
- Atomic Density: 0.051744904747412536
- Unit Cell Volume: 115.95344564432743
- Molar Volume: 11.638132854619146
- Full Formula: C2 N2 Cl2
- Reduced Formula: CNCl
- Formula Anonymous: ABC
- Spacegroup Number: 59
- Spacegroup Symbol: Pmmn1
- Crystal System: orthorhombic
- Pointgroup: mmm
