Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-40165
- 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: 24
- Number of elements: 4
- Element list: ['Cu', 'H', 'N', 'Cl']
- Chemical System: Cl-Cu-H-N
- Density: 2.6365612067643243
- Atomic Density: 0.08210536102352524
- Unit Cell Volume: 292.3073438910207
- Molar Volume: 7.3346498753893865
- Full Formula: Cu4 H12 N4 Cl4
- Reduced Formula: CuH3NCl
- Formula Anonymous: ABCD3
- Spacegroup Number: 199
- Spacegroup Symbol: I2_13
- Crystal System: cubic
- Pointgroup: 23
