Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-44239
- Created at: Sept. 4, 2022, 3:51 p.m.
- Last updated at: Sept. 4, 2022, 3:51 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 64
- Number of elements: 3
- Element list: ['Cl', 'N', 'P']
- Chemical System: Cl-N-P
- Density: 2.1409458619430985
- Atomic Density: 0.04450244531450599
- Unit Cell Volume: 1438.123221043285
- Molar Volume: 13.532156980230088
- Full Formula: P16 N16 Cl32
- Reduced Formula: PNCl2
- Formula Anonymous: ABC2
- Spacegroup Number: 86
- Spacegroup Symbol: P4_2/n
- Crystal System: tetragonal
- Pointgroup: 4/m
