Structure:
- Number of sites: {{ calculation.nsites }}
- Number of elements: {{ calculation.nelements }}
- Element list: {{ calculation.elements }}
- Chemical System: {{ calculation.chemical_system }}
- Density: {{ calculation.density }}
- Atomic Density: {{ calculation.density_atomic }}
- Unit Cell Volume: {{ calculation.volume }}
- Molar Volume: {{ calculation.volume_molar }}
- Full Formula: {{ calculation.formula_full }}
- Reduced Formula: {{ calculation.formula_reduced }}
- Formula Anonymous: {{ calculation.formula_anonymous }}
- Spacegroup Number: {{ calculation.spacegroup.number }}
- Spacegroup Symbol: {{ calculation.spacegroup.symbol }}
- Crystal System: {{ calculation.spacegroup.crystal_system }}
- Pointgroup: {{ calculation.spacegroup.point_group }}