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16 lines
469 B
Fortran
16 lines
469 B
Fortran
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BEGIN_PROVIDER [double precision, kinetic_density_generalized, (n_points_final_grid)]
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implicit none
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integer :: i,j,m,i_point
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kinetic_density_generalized = 0.d0
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do i_point = 1, n_points_final_grid
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do i = 1, mo_num
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do j = 1, mo_num
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do m = 1, 3
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kinetic_density_generalized(i_point) += 0.5d0 * mos_grad_in_r_array_tranp(m,j,i_point) * mos_grad_in_r_array_tranp(m,i,i_point) * one_e_dm_mo_for_dft(j,i,1)
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enddo
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enddo
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enddo
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enddo
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END_PROVIDER
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