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(git:936074a)
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Distribution of the electric field gradient integral matrix. More...
Functions/Subroutines | |
| subroutine, public | build_efg_matrix (qs_env, matrix_efg, rc) |
| Calculation of the electric field gradient matrix over Cartesian Gaussian functions. | |
Distribution of the electric field gradient integral matrix.
| subroutine, public qs_elec_field::build_efg_matrix | ( | type(qs_environment_type), pointer | qs_env, |
| type(dbcsr_p_type), dimension(:), pointer | matrix_efg, | ||
| real(dp), dimension(3), intent(in) | rc | ||
| ) |
Calculation of the electric field gradient matrix over Cartesian Gaussian functions.
| qs_env | ... |
| matrix_efg | ... |
| rc | ... |
Definition at line 74 of file qs_elec_field.F.