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module | qs_linres_atom_current |
| given the response wavefunctions obtained by the application of the (rxp), p, and ((dk-dl)xp) operators, here the current density vector (jx, jy, jz) is computed for the 3 directions of the magnetic field (Bx, By, Bz)
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subroutine, public | qs_linres_atom_current::calculate_jrho_atom_coeff (qs_env, current_env, mat_d0, mat_jp, mat_jp_rii, mat_jp_riii, iB, idir) |
| Calculate the expansion coefficients for the atomic terms of the current densitiy in GAPW. More...
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subroutine, public | qs_linres_atom_current::calculate_jrho_atom_rad (qs_env, current_env, idir) |
| ... More...
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subroutine, public | qs_linres_atom_current::calculate_jrho_atom (current_env, qs_env, iB, idir) |
| ... More...
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