- optimization_points - Number of points used to optimize the real-space projectors.
- integer; > 0; 171
ncp_data_mod; NA; NA
default is used
RESET THIS VALUE ONLY IF YOU UNDERSTAND THE OPTIMIZATION ROUTINE! - projector_radius_xxx - Radius used to optimize real-space projectors for atom type xxx.
- real number; < radius of sphere which will fit inside the supercell; 4.0
ncp_data_mod; ncp_data_obj; pd%o%r_opt
run aborts - projector_type - Type of non-local projectors to use.
- character; RECIPROCAL, REAL; RECIPROCAL
hamiltonian_mod; h_common_obj; hc%o%projector_type
default value used
RECIPROCAL invokes reciprocal-spaced projectors
REAL invokes real-space projectors constructed using the scheme proposed by King-Smith et al.
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