Searched refs:integral_sort (Results 1 – 2 of 2) sorted by relevance
| /dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/mlcc/ |
| H A D | mlccsdpt_integrals.F90 | 42 real(dp), dimension(:), pointer, private :: integral_sort => null() variable
146 call work_allocator(integral_sort,n_vir_aag)
338 call bDck_order(b_D_c_k,integral_sort,n_vir_act,n_vir_gen,k_off,batch_size)
347 write(bDck_print_unit,rec=k,iostat=ioerror) integral_sort(1:n_vir_aag)
370 call Ljck_order(L_j_c_k,integral_sort,n_vir_act,n_vir_gen,&
380 write(Ljck_print_unit,rec=rec_number,iostat=ioerror) integral_sort(1:n_occ_print)
396 call jbkc_order(j_b_k_c,integral_sort,n_vir_act,n_vir_gen,&
406 write(jbkc_print_unit,rec=rec_number,iostat=ioerror) integral_sort(1:n_vir_act**2)
477 call work_deallocator(integral_sort)
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| H A D | mlcc3_intermediates.F90 | 48 real(dp), dimension(:), pointer, private :: integral_sort => null() variable
187 call work_allocator(integral_sort,n_vir_aag)
446 call bDck_order(b_D_c_k,integral_sort,n_vir_act,n_vir_gen,k_off,batch_size)
455 write(bDck_print_unit,rec=k,iostat=ioerror) integral_sort(1:n_vir_aag)
470 call Dbkc_order(D_b_k_c,integral_sort,n_vir_act,n_vir_gen,k_off,batch_size)
479 write(Dbkc_print_unit,rec=k,iostat=ioerror) integral_sort(1:n_vir_aag)
501 call Ljck_order(L_j_c_k,integral_sort,n_vir_act,n_vir_gen,&
511 write(Ljck_print_unit,rec=rec_number,iostat=ioerror) integral_sort(1:n_occ_print)
526 call jLkc_order(j_L_k_c,integral_sort,n_vir_act,n_vir_gen,&
554 call jbkc_order(j_b_k_c,integral_sort,n_vir_act,n_vir_gen,&
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