Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-118030
- 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: ['H', 'N', 'Cl']
- Chemical System: Cl-H-N
- Density: 2.2787833879739487
- Atomic Density: 0.08157596231171839
- Unit Cell Volume: 36.77553920279099
- Molar Volume: 7.3822491201368505
- Full Formula: H1 N1 Cl1
- Reduced Formula: HNCl
- Formula Anonymous: ABC
- Spacegroup Number: 187
- Spacegroup Symbol: P-6m2
- Crystal System: hexagonal
- Pointgroup: -6m2
