Calculation Styles
- E_vs_r_scan
- bond_angle_scan
- crystal_space_group
- diatom_scan
- dislocation_SDVPN
- dislocation_monopole
- dislocation_periodic_array
- elastic_constants_static
- energy_check
- free_energy
- free_energy_liquid
- isolated_atom
- phonon
- point_defect_diffusion
- point_defect_static
- relax_box
- relax_dynamic
- relax_liquid
- relax_static
- stacking_fault_map_2D
- stacking_fault_static
- surface_energy_static