Loop id | Source Location | Source Function | Level | Coverage run_0 (%) | Max Time Over Threads run_0 (s) | Time w.r.t. Wall Time run_0 (s) | Nb Threads run_0 | GFLOPS run_0 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing run_0 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect |
---|
95225 | cp2k.ssmp - grid_ref_collint.h:64-69 | ortho_cxyz_to_grid#0x25f0030 | Innermost | 11.79 | 164.36 | 164.36 | 1 | 2.04 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 1 | 0 |
95248 | cp2k.ssmp - grid_ref_collint.h:48-204 [...] | ortho_cxyz_to_grid | InBetween | 10.51 | 146.53 | 146.53 | 1 | 2.39 | 5.65 | 27.75 | 1.14 | 1.28 | 2.59 | 1 | 1 | 4.5 | 0.5 | 0 | 0 |
164712 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 7.77 | 108.38 | 108.38 | 1 | 7.88 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 9 | 0 | 0 | 0 |
95249 | cp2k.ssmp - grid_ref_collint.h:49-54 | ortho_cxyz_to_grid | Innermost | 7.04 | 98.11 | 98.11 | 1 | 2.55 | 0 | 25 | 1 | 1.14 | 4 | 1 | 0 | 1 | 0 | 1 | 0 |
95224 | cp2k.ssmp - grid_ref_collint.h:63-204 [...] | ortho_cxyz_to_grid#0x25f0030 | InBetween | 4.64 | 64.62 | 64.62 | 1 | 1.99 | 0 | 20.83 | 3.8 | 1 | 6.33 | 1 | NA | NA | NA | NA | NA |
164710 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | InBetween | 2.54 | 35.41 | 35.41 | 1 | 7.34 | 9.64 | 27.26 | 2.25 | 1.07 | 4.17 | 1 | NA | NA | NA | NA | NA |
209992 | cp2k.ssmp - | mkl_blas_def_dgemm_kernel_zen | Innermost | 2.23 | 31.03 | 31.03 | 1 | 29.94 | 78.95 | 84.21 | 1 | 1 | 1.03 | 1 | 0 | 2 | 0 | 0 | 0 |
111102 | cp2k.ssmp - xc_pbe.F:513-1312 [...] | pbe_lda_calc | Single | 2.22 | 31.01 | 31.01 | 1 | 3.33 | 1.3 | 25.27 | 1.01 | 1.22 | 4 | 1 | NA | NA | NA | NA | NA |
95220 | cp2k.ssmp - grid_ref_collint.h:44-389 [...] | ortho_cxyz_to_grid#0x25f0030 | InBetween | 2.08 | 28.95 | 28.95 | 1 | 2.01 | 0 | 16.5 | 1 | 1 | 7.24 | 1 | NA | NA | NA | NA | NA |
95226 | cp2k.ssmp - grid_ref_collint.h:64-69 | ortho_cxyz_to_grid#0x25f0030 | Innermost | 2.05 | 28.61 | 28.61 | 1 | 2.69 | 32.08 | 40.57 | 1 | 1 | 3.09 | 1 | 0 | 1 | 0 | 2 | 0 |
164696 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Outermost | 2.05 | 28.53 | 28.53 | 1 | 7.71 | 15.29 | 28.82 | 3.03 | 2.43 | 3.99 | 1 | NA | NA | NA | NA | NA |
95250 | cp2k.ssmp - grid_ref_collint.h:224-234 | ortho_cxyz_to_grid | Innermost | 1.63 | 22.79 | 22.79 | 1 | 2.58 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
95221 | cp2k.ssmp - grid_ref_collint.h:224-240 [...] | ortho_cxyz_to_grid#0x25f0030 | Innermost | 1.47 | 20.55 | 20.55 | 1 | 2.20 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
95246 | cp2k.ssmp - grid_ref_collint.h:48-389 [...] | ortho_cxyz_to_grid | InBetween | 1.27 | 17.67 | 17.67 | 1 | 2.35 | 0 | 20.19 | 1 | 1.22 | 7.38 | 1 | NA | NA | NA | NA | NA |
164713 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 1.07 | 14.89 | 14.89 | 1 | 4.92 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 9 | 0 | 0 | 0 |
95247 | cp2k.ssmp - grid_ref_collint.h:48-204 [...] | ortho_cxyz_to_grid | InBetween | 1.04 | 14.47 | 14.47 | 1 | 2.37 | 5.13 | 22.52 | 1.95 | 1 | 7.34 | 1 | 1.67 | 0 | 0 | 7 | 0 |
95223 | cp2k.ssmp - grid_ref_collint.h:63-204 [...] | ortho_cxyz_to_grid#0x25f0030 | InBetween | 0.79 | 10.97 | 10.97 | 1 | 1.96 | 0 | 19.85 | 1 | 1 | 6.44 | 1 | NA | NA | NA | NA | NA |
164711 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.78 | 10.86 | 10.86 | 1 | 5.10 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 9 | 0 | 0 | 0 |
116452 | cp2k.ssmp - pw_methods.F:1325-1331 | pw_gather_s___0_1325__par_loop1_2_52 | Single | 0.77 | 10.75 | 10.75 | 1 | 0.00 | 100 | 50 | 2 | 1 | 2 | 1 | 1 | 1 | 0 | 5 | 2 |
98423 | cp2k.ssmp - dbcsr_vector.F:1129-1129 | dbcsr_sym_matrix_vector_mult_d | Innermost | 0.77 | 10.73 | 10.73 | 1 | 0.79 | 0 | 25 | 1.17 | 1.17 | 4 | 1 | 0 | 1 | 0 | 1 | 0 |
95240 | cp2k.ssmp - grid_ref_collint.h:48-485 [...] | ortho_cxyz_to_grid | InBetween | 0.77 | 10.74 | 10.74 | 1 | 2.42 | 2.38 | 17.86 | 1 | 1 | 6.38 | 1 | NA | NA | NA | NA | NA |
95213 | cp2k.ssmp - grid_ref_collint.h:44-489 [...] | ortho_cxyz_to_grid#0x25f0030 | InBetween | 0.68 | 9.41 | 9.41 | 1 | 2.13 | 3.45 | 19.4 | 1 | 1 | 6.8 | 1 | NA | NA | NA | NA | NA |
210005 | cp2k.ssmp - | mkl_blas_def_dgemm_copyan_bdz | Innermost | 0.63 | 8.71 | 8.71 | 1 | 3.80 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 2 | 0 |
210001 | cp2k.ssmp - | mkl_blas_def_dgemm_copybn_bdz | Innermost | 0.62 | 8.66 | 8.66 | 1 | 5.34 | 0 | 25 | 1 | 1.5 | 6 | 1 | 0 | 5 | 0 | 0 | 0 |
116463 | cp2k.ssmp - pw_methods.F:1476-1482 | pw_scatter_s___0_1476__par_loop1_2_54 | Single | 0.61 | 8.51 | 8.51 | 1 | 0.00 | 100 | 50 | 2 | 1 | 2 | 1 | 1 | 1 | 0 | 5 | 2 |
242871 | cp2k.ssmp - | mkl_dft_def_ownscDftInv_Fact5_64fc | Innermost | 0.54 | 7.48 | 7.47 | 1 | 7.70 | 72.97 | 43.24 | 1 | 1.46 | 2.4 | 1 | 1 | 11 | 0 | 0 | 0 |
164707 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.51 | 7.09 | 7.09 | 1 | 10.55 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 5 | 0 | 0 | 0 |
242797 | cp2k.ssmp - | mkl_dft_def_ownscDftFwd_Fact5_64fc | Innermost | 0.51 | 7.04 | 7.04 | 1 | 7.02 | 72.97 | 43.24 | 1 | 1.46 | 2.4 | 1 | 1 | 11 | 0 | 0 | 0 |
163867 | cp2k.ssmp - | mkl_blas_def_xdgemv | Innermost | 0.45 | 6.22 | 6.22 | 1 | 16.41 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 9 | 0 | 0 | 0 |
95251 | cp2k.ssmp - grid_ref_collint.h:223-262 [...] | ortho_cxyz_to_grid | InBetween | 0.38 | 5.24 | 5.24 | 1 | 2.31 | 0 | 22.22 | 2.33 | 1 | 5.71 | 1 | 1 | 1 | 2 | 1 | 0 |
95222 | cp2k.ssmp - grid_ref_collint.h:223-269 [...] | ortho_cxyz_to_grid#0x25f0030 | InBetween | 0.35 | 4.88 | 4.88 | 1 | 2.13 | 0 | 16.67 | 1.5 | 1 | 6 | 1 | 1 | 1 | 0 | 3 | 0 |
209993 | cp2k.ssmp - | mkl_blas_def_dgemm_kernel_zen | InBetween | 0.35 | 4.86 | 4.86 | 1 | 10.67 | 92.31 | 94.23 | 1 | 1 | 1 | 1 | 0 | 6 | 0 | 0 | 0 |
164698 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.34 | 4.8 | 4.8 | 1 | 9.02 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 2 | 0 | 0 | 0 |
164708 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.33 | 4.57 | 4.57 | 1 | 5.95 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 5 | 0 | 0 | 0 |
95208 | cp2k.ssmp - grid_ref_collint.h:329-343 [...] | ortho_cxyz_to_grid#0x25f0030 | Innermost | 0.32 | 4.52 | 4.52 | 1 | 2.32 | 0 | 25 | 1.11 | 1.11 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
164697 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.31 | 4.37 | 4.37 | 1 | 9.13 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
242845 | cp2k.ssmp - | mkl_dft_def_ownscDftInv_Prime5_64fc | Innermost | 0.31 | 4.35 | 4.35 | 1 | 6.13 | 100 | 50 | 1 | 1.4 | 2 | 1 | 1 | 1 | 0 | 5 | 0 |
270871 | cp2k.ssmp - | __intel_avx_rep_memcpy | Single | 0.3 | 4.12 | 4.12 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 0 | 0 | 2 | 0 |
98419 | cp2k.ssmp - dbcsr_vector.F:1129-1129 | dbcsr_sym_matrix_vector_mult_d | InBetween | 0.29 | 3.98 | 3.98 | 1 | 0.87 | 0 | 24.7 | 4.13 | 1 | 6.38 | 1 | NA | NA | NA | NA | NA |
135976 | cp2k.ssmp - dbcsr_mm_csr.F:270-808 [...] | dbcsr_mm_csr_multiply | InBetween | 0.28 | 3.91 | 3.91 | 1 | 0.22 | 0 | 14.91 | 6.35 | 3.66 | 19.71 | 1 | NA | NA | NA | NA | NA |
242771 | cp2k.ssmp - | mkl_dft_def_ownscDftFwd_Prime5_64fc | Innermost | 0.27 | 3.7 | 3.7 | 1 | 6.23 | 100 | 50 | 1 | 1.4 | 2 | 1 | 1 | 1 | 0 | 5 | 0 |
95227 | cp2k.ssmp - grid_ref_collint.h:460-464 | ortho_cxyz_to_grid#0x25f0030 | Innermost | 0.27 | 3.73 | 3.73 | 1 | 2.58 | 0 | 16.01 | 1 | 1 | 7.1 | 1 | 0 | 1 | 0.67 | 0 | 0 |
95258 | cp2k.ssmp - grid_ref_collint.h:460-464 | ortho_cxyz_to_grid | Innermost | 0.26 | 3.56 | 3.56 | 1 | 2.76 | 0 | 16.01 | 1 | 1 | 7.1 | 1 | 0 | 1 | 0.67 | 0 | 0 |
140568 | cp2k.ssmp - | mkl_trans_def_mkl_dimatcopy_mipt_t | Innermost | 0.26 | 3.58 | 3.58 | 1 | 0.02 | 0 | 22.5 | 1 | 1 | 4 | 1 | 0 | 0 | 0 | 0 | 0 |
95326 | cp2k.ssmp - grid_ref_collint.h:1112-1123 | cab_to_grid | InBetween | 0.25 | 3.48 | 3.48 | 1 | 1.97 | 0 | 21.67 | 2.57 | 1.71 | 5.76 | 1 | NA | NA | NA | NA | NA |
95238 | cp2k.ssmp - grid_ref_collint.h:48-485 [...] | ortho_cxyz_to_grid | Outermost | 0.24 | 3.31 | 3.31 | 1 | 2.43 | 6.9 | 21.55 | 1 | 1 | 5.92 | 1 | NA | NA | NA | NA | NA |
164703 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.24 | 3.31 | 3.31 | 1 | 10.92 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 3 | 0 | 0 | 0 |
95205 | cp2k.ssmp - grid_ref_collint.h:44-491 [...] | ortho_cxyz_to_grid#0x25f0030 | Outermost | 0.24 | 3.34 | 3.34 | 1 | 2.15 | 6.9 | 24.57 | 1 | 1.04 | 6.14 | 1 | NA | NA | NA | NA | NA |
164706 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.24 | 3.4 | 3.4 | 1 | 10.13 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 5 | 0 | 0 | 0 |
164701 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | InBetween | 0.2 | 2.8 | 2.8 | 1 | 8.28 | 20 | 30 | 2.33 | 2.3 | 4 | 1 | NA | NA | NA | NA | NA |
95252 | cp2k.ssmp - grid_ref_collint.h:328-484 [...] | ortho_cxyz_to_grid | InBetween | 0.19 | 2.65 | 2.65 | 1 | 2.74 | 0 | 15.87 | 3.18 | 1 | 7.58 | 1 | NA | NA | NA | NA | NA |
133562 | cp2k.ssmp - dbcsr_mpiwrap.F:2654-2656 | alltoall_d11v#omp_loop_0 | Single | 0.19 | 2.68 | 2.68 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
270872 | cp2k.ssmp - | __intel_avx_rep_memcpy | Single | 0.18 | 2.46 | 2.46 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
164709 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.18 | 2.53 | 2.53 | 1 | 5.70 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 5 | 0 | 0 | 0 |
140571 | cp2k.ssmp - | mkl_trans_def_mkl_dimatcopy_mipt_t | Innermost | 0.18 | 2.45 | 2.45 | 1 | 0.03 | 5.88 | 24.26 | 75 | 1 | 4 | 1 | NA | NA | NA | NA | NA |
95206 | cp2k.ssmp - grid_ref_collint.h:328-491 [...] | ortho_cxyz_to_grid#0x25f0030 | InBetween | 0.17 | 2.34 | 2.34 | 1 | 2.05 | 0 | 17.76 | 3 | 1 | 7.27 | 1 | NA | NA | NA | NA | NA |
95289 | cp2k.ssmp - grid_ref_collint.h:1113-1121 | grid_ref_collocate_pgf_product | Innermost | 0.16 | 2.27 | 2.27 | 1 | 1.17 | 0 | 25 | 1 | 2 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
95366 | cp2k.ssmp - grid_ref_task_list.c:195-567 [...] | grid_ref_integrate_task_list | Innermost | 0.16 | 2.27 | 2.27 | 1 | 1.34 | 2.06 | 19.75 | 10.63 | 1.26 | 11.97 | 1 | NA | NA | NA | NA | NA |
164699 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.16 | 2.23 | 2.23 | 1 | 3.71 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 2 | 0 | 0 | 0 |
62627 | cp2k.ssmp - core_ppl.F:439-497 [...] | build_core_ppl | InBetween | 0.15 | 2.06 | 2.06 | 1 | 0.56 | 0.23 | 24.19 | 26.34 | 2.47 | 10.65 | 1 | NA | NA | NA | NA | NA |
164702 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.15 | 2.1 | 2.1 | 1 | 11.65 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 3 | 0 | 0 | 0 |
95332 | cp2k.ssmp - grid_ref_collint.h:1073-1077 | cab_to_grid | Innermost | 0.14 | 1.92 | 1.92 | 1 | 2.39 | 16.67 | 27.08 | 1 | 2.89 | 4 | 1 | 0 | 0 | 0 | 1 | 0 |
95228 | cp2k.ssmp - grid_ref_collint.h:450-451 [...] | ortho_cxyz_to_grid#0x25f0030 | Innermost | 0.14 | 1.88 | 1.88 | 1 | 2.18 | 0 | 12.5 | 1 | 1 | 8 | 1 | 0 | 1 | 0 | 0 | 0 |
95254 | cp2k.ssmp - grid_ref_collint.h:329-339 | ortho_cxyz_to_grid | Innermost | 0.14 | 1.91 | 1.91 | 1 | 2.80 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
114414 | cp2k.ssmp - ai_oneelectron.F:179-337 [...] | os_3center | Innermost | 0.13 | 1.77 | 1.77 | 1 | 0.70 | 0 | 15.63 | 1 | 1 | 8 | 1 | 1 | 0 | 1 | 5 | 0 |
95259 | cp2k.ssmp - grid_ref_collint.h:450-451 [...] | ortho_cxyz_to_grid | Innermost | 0.13 | 1.74 | 1.74 | 1 | 2.29 | 0 | 12.5 | 1 | 1 | 8 | 1 | 0 | 1 | 0 | 0 | 0 |
95255 | cp2k.ssmp - grid_ref_collint.h:329-339 [...] | ortho_cxyz_to_grid | Innermost | 0.13 | 1.81 | 1.81 | 1 | 2.55 | 38.46 | 34.62 | 1 | 1 | 3.6 | 1 | 0 | 3 | 0 | 0 | 0 |
164704 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.13 | 1.8 | 1.8 | 1 | 5.46 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 3 | 0 | 0 | 0 |
164700 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.13 | 1.86 | 1.86 | 1 | 4.13 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
171230 | cp2k.ssmp - | mkl_dft_def_gather_z_z | Single | 0.13 | 1.84 | 1.84 | 1 | 1.00 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 0 | 7 | 3 | 0 |
95327 | cp2k.ssmp - grid_ref_collint.h:1113-1123 | cab_to_grid | Innermost | 0.12 | 1.72 | 1.72 | 1 | 2.36 | 0 | 25 | 1 | 2.96 | 4 | 1 | 0 | 1 | 0 | 0 | 1 |
95297 | cp2k.ssmp - grid_ref_collint.h:1073-1077 | grid_ref_collocate_pgf_product | Innermost | 0.12 | 1.61 | 1.61 | 1 | 1.71 | 16.67 | 27.08 | 1 | 2.89 | 4 | 1 | 0 | 0 | 0 | 1 | 0 |
140569 | cp2k.ssmp - | mkl_trans_def_mkl_dimatcopy_mipt_t | InBetween | 0.12 | 1.64 | 1.64 | 1 | 0.00 | 3.7 | 23.61 | 83.33 | 1 | 4 | 1 | NA | NA | NA | NA | NA |
135022 | cp2k.ssmp - dbcsr_mm_hostdrv.F:287-298 [...] | blas_process_mm_stack_d | Single | 0.12 | 1.67 | 1.67 | 1 | 3.83 | 0 | 21.15 | 1 | 1.57 | 8.31 | 1 | 1 | 0 | 3 | 0 | 0 |
98439 | cp2k.ssmp - dbcsr_vector.F:1123-1123 | dbcsr_sym_matrix_vector_mult_d | Innermost | 0.11 | 1.47 | 1.47 | 1 | 0.50 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
95373 | cp2k.ssmp - grid_ref_prepare_pab.c:57-63 [...] | grid_ref_prepare_pab | Innermost | 0.11 | 1.55 | 1.55 | 1 | 2.03 | 0 | 16.32 | 5.04 | 1 | 6.59 | 1 | 1 | 0 | 1 | 1.75 | 0 |
95362 | cp2k.ssmp - grid_ref_task_list.c:195-329 [...] | grid_ref_collocate_task_list | Innermost | 0.11 | 1.56 | 1.56 | 1 | 2.64 | 0.96 | 18.99 | 6.96 | 1.26 | 12.54 | 1 | NA | NA | NA | NA | NA |
116501 | cp2k.ssmp - pw_methods.F:1010-1012 | pw_axpy | Single | 0.11 | 1.51 | 1.51 | 1 | 1.07 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
114294 | cp2k.ssmp - ai_oneelectron.F:170-575 [...] | os_3center | InBetween | 0.1 | 1.34 | 1.34 | 1 | 0.44 | 13.73 | 27.35 | 4.55 | 1.67 | 5.29 | 1 | NA | NA | NA | NA | NA |
171231 | cp2k.ssmp - | mkl_dft_def_gather_z_z | Single | 0.1 | 1.39 | 1.39 | 1 | 0.13 | 100 | 50 | 1 | 1 | 2 | 1 | 1 | 1 | 7 | 0 | 4 |
139598 | cp2k.ssmp - | mkl_xomatcopy2_rec_t_1 | Outermost | 0.1 | 1.32 | 1.32 | 1 | 0.02 | 0 | 23.21 | 1 | 1 | 6.48 | 1 | NA | NA | NA | NA | NA |
95233 | cp2k.ssmp - grid_ref_collint.h:421-428 | ortho_cxyz_to_grid#0x25f0030 | InBetween | 0.1 | 1.37 | 1.37 | 1 | 0.53 | 9.52 | 22.62 | 2.57 | 2.05 | 6.2 | 1 | NA | NA | NA | NA | NA |
114385 | cp2k.ssmp - ai_oneelectron.F:335-347 | os_3center | InBetween | 0.09 | 1.19 | 1.19 | 1 | 0.70 | 5 | 17.5 | 2.92 | 2.37 | 6.83 | 1 | NA | NA | NA | NA | NA |
95264 | cp2k.ssmp - grid_ref_collint.h:421-428 | ortho_cxyz_to_grid | InBetween | 0.09 | 1.29 | 1.29 | 1 | 0.83 | 9.52 | 22.62 | 2.57 | 2.05 | 6.2 | 1 | NA | NA | NA | NA | NA |
121450 | cp2k.ssmp - fast.F:136-136 | copy_cr#omp_region_0 | Innermost | 0.09 | 1.32 | 1.32 | 1 | 0.00 | 33.33 | 33.33 | 1.17 | 1 | 2.33 | 1 | 0 | 1 | 1 | 0 | 0 |
62339 | cp2k.ssmp - core_ppl.F:185-586 [...] | build_core_ppl | Outermost | 0.09 | 1.24 | 1.24 | 1 | 0.42 | 3.17 | 25.4 | 2.5 | 1.74 | 5.2 | 1 | NA | NA | NA | NA | NA |
126171 | cp2k.ssmp - kahan_sum.F:553-556 | kahan_sum_d3 | Innermost | 0.09 | 1.25 | 1.25 | 1 | 1.09 | 0 | 25 | 1 | 2.8 | 4 | 1 | 0 | 1 | 0 | 0 | 0 |
95288 | cp2k.ssmp - grid_ref_collint.h:1112-1121 | grid_ref_collocate_pgf_product | InBetween | 0.08 | 1.09 | 1.09 | 1 | 1.13 | 0 | 18.38 | 3.07 | 1 | 7.21 | 1 | NA | NA | NA | NA | NA |
210000 | cp2k.ssmp - | mkl_blas_def_dgemm_copybn_bdz | Outermost | 0.08 | 1.1 | 1.1 | 1 | 5.08 | 0 | 23.44 | 1 | 1.32 | 6.51 | 1 | 1 | 0.5 | 0.25 | 3.5 | 0 |
121458 | cp2k.ssmp - fast.F:155-155 | copy_rc#omp_region_0 | Innermost | 0.08 | 1.1 | 1.1 | 1 | 0.00 | 100 | 71.43 | 1 | 1 | 1.33 | 1 | 0 | 2 | 0 | 0 | 0 |
171282 | cp2k.ssmp - | mkl_dft_def_dfti_mem_methods_init | Single | 0.08 | 1.12 | 1.12 | 1 | 7.70 | 98.46 | 49.62 | 1 | 1 | 2 | 1 | 0 | 0 | 0 | 12 | 0 |
95232 | cp2k.ssmp - grid_ref_collint.h:438-440 | ortho_cxyz_to_grid#0x25f0030 | Innermost | 0.08 | 1.06 | 1.06 | 1 | 0.69 | 0 | 25 | 1 | 2.29 | 4 | 1 | 0 | 0 | 0 | 2 | 0 |
116362 | cp2k.ssmp - pw_methods.F:669-669 | pw_derive | Single | 0.08 | 1.09 | 1.09 | 1 | 5.25 | 100 | 85.71 | 1 | 1 | 1.17 | 1 | 0 | 0 | 0 | 1 | 0 |
95262 | cp2k.ssmp - grid_ref_collint.h:433-440 | ortho_cxyz_to_grid | InBetween | 0.08 | 1.16 | 1.16 | 1 | 0.86 | 10.53 | 22.37 | 2.29 | 2.13 | 6.33 | 1 | NA | NA | NA | NA | NA |
136972 | cp2k.ssmp - dbcsr_block_operations.F:1559-1560 | block_partial_copy_1d2d_d | Innermost | 0.08 | 1.15 | 1.15 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
95235 | cp2k.ssmp - grid_ref_collint.h:411-440 | ortho_cxyz_to_grid | Outermost | 0.08 | 1.12 | 1.12 | 1 | 0.78 | 10 | 26.88 | 1.82 | 1.53 | 4.68 | 1 | NA | NA | NA | NA | NA |
95231 | cp2k.ssmp - grid_ref_collint.h:433-440 | ortho_cxyz_to_grid#0x25f0030 | InBetween | 0.08 | 1.1 | 1.1 | 1 | 0.66 | 10.53 | 22.37 | 2.29 | 2.13 | 6.33 | 1 | NA | NA | NA | NA | NA |
162368 | cp2k.ssmp - | mkl_blas_mc_cgemm_pst | Single | 0.07 | 0.94 | 0.94 | 1 | 1.86 | 92.31 | 48.08 | 1 | 1 | 2 | 1 | 0 | 1 | 0 | 0 | 0 |
95303 | cp2k.ssmp - grid_ref_integrate.c:65-121 [...] | grid_ref_integrate_pgf_product | InBetween | 0.07 | 0.99 | 0.99 | 1 | 1.38 | 0 | 18.48 | 6.42 | 2.83 | 7.46 | 1 | NA | NA | NA | NA | NA |
95300 | cp2k.ssmp - grid_ref_integrate.c:60-121 [...] | grid_ref_integrate_pgf_product | InBetween | 0.07 | 0.99 | 0.99 | 1 | 1.90 | 6.12 | 17.86 | 11.4 | 1.58 | 11.68 | 1 | NA | NA | NA | NA | NA |
171278 | cp2k.ssmp - | mkl_dft_def_dfti_mem_methods_init | Single | 0.07 | 0.91 | 0.91 | 1 | 4.75 | 98.46 | 49.62 | 1 | 1 | 2 | 1 | 0 | 0 | 0 | 12 | 0 |
242872 | cp2k.ssmp - | mkl_dft_def_ownscDftInv_Fact5_64fc | Outermost | 0.07 | 1.04 | 1.04 | 1 | 6.08 | 94 | 48.5 | 1 | 1.4 | 2 | 1 | 1 | 0 | 11 | 0 | 0 |
95234 | cp2k.ssmp - grid_ref_collint.h:426-428 | ortho_cxyz_to_grid#0x25f0030 | Innermost | 0.07 | 0.99 | 0.99 | 1 | 0.61 | 0 | 25 | 1 | 2.29 | 4 | 1 | 0 | 0 | 0 | 2 | 0 |
95202 | cp2k.ssmp - grid_ref_collint.h:411-440 | ortho_cxyz_to_grid#0x25f0030 | Outermost | 0.07 | 0.93 | 0.93 | 1 | 0.60 | 10 | 26.88 | 1.82 | 1.53 | 4.68 | 1 | NA | NA | NA | NA | NA |
114262 | cp2k.ssmp - ai_overlap_ppl.F:453-473 [...] | ppl_integral | Innermost | 0.07 | 1.01 | 1.01 | 1 | 0.60 | 7.69 | 25.96 | 1 | 2 | 4 | 1 | 1 | 3 | 0 | 1 | 0 |
163865 | cp2k.ssmp - | mkl_blas_def_xdgemv | Outermost | 0.07 | 0.97 | 0.97 | 1 | 12.49 | 9.88 | 27.31 | 2.25 | 1.12 | 4.3 | 1 | NA | NA | NA | NA | NA |
209973 | cp2k.ssmp - | mkl_blas_def_xdgemm_bdz | InBetween | 0.07 | 0.94 | 0.94 | 1 | 10.85 | 0 | 23.02 | 1 | 1 | 8.73 | 1 | 2 | 0 | 1.75 | 1.75 | 0.5 |
95265 | cp2k.ssmp - grid_ref_collint.h:426-428 | ortho_cxyz_to_grid | Innermost | 0.07 | 0.98 | 0.98 | 1 | 0.71 | 0 | 25 | 1 | 2.29 | 4 | 1 | 0 | 0 | 0 | 2 | 0 |
95309 | cp2k.ssmp - grid_ref_integrate.c:78-81 [...] | grid_ref_integrate_pgf_product | InBetween | 0.06 | 0.78 | 0.78 | 1 | 0.89 | 4.17 | 18.75 | 4.14 | 1.08 | 5.66 | 1 | NA | NA | NA | NA | NA |
116458 | cp2k.ssmp - pw_methods.F:1460-1460 | pw_scatter_s_..0 | Innermost | 0.06 | 0.88 | 0.88 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 1 | 0 | 0 | 0 |
62414 | cp2k.ssmp - core_ppl.F:516-516 | build_core_ppl | InBetween | 0.06 | 0.85 | 0.85 | 1 | 0.91 | 0 | 24.54 | 2.59 | 1 | 6.21 | 1 | NA | NA | NA | NA | NA |
114388 | cp2k.ssmp - ai_oneelectron.F:345-347 | os_3center | Innermost | 0.06 | 0.86 | 0.86 | 1 | 0.75 | 0 | 25 | 1 | 1.33 | 4 | 1 | 0 | 3 | 0 | 0 | 1 |
116360 | cp2k.ssmp - pw_methods.F:655-655 | pw_derive | Single | 0.06 | 0.83 | 0.83 | 1 | 0.77 | 57.14 | 53.57 | 1 | 1 | 1.6 | 1 | 0 | 2 | 0 | 2 | 0 |
116340 | cp2k.ssmp - pw_methods.F:633-633 | pw_derive | Single | 0.06 | 0.83 | 0.83 | 1 | 0.77 | 57.14 | 53.57 | 1 | 1 | 1.6 | 1 | 0 | 2 | 0 | 2 | 0 |
95253 | cp2k.ssmp - grid_ref_collint.h:327-484 [...] | ortho_cxyz_to_grid | InBetween | 0.06 | 0.8 | 0.8 | 1 | 2.99 | 0 | 16.41 | 1 | 1.13 | 7.58 | 1 | NA | NA | NA | NA | NA |
95207 | cp2k.ssmp - grid_ref_collint.h:327-491 [...] | ortho_cxyz_to_grid#0x25f0030 | InBetween | 0.06 | 0.82 | 0.82 | 1 | 2.18 | 0 | 16.07 | 1 | 1.03 | 8 | 1 | NA | NA | NA | NA | NA |
131622 | cp2k.ssmp - dbcsr_operations.F:2784-2784 | dbcsr_dot_d | Innermost | 0.06 | 0.83 | 0.83 | 1 | 1.83 | 0 | 25 | 1 | 2.11 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
95263 | cp2k.ssmp - grid_ref_collint.h:438-440 | ortho_cxyz_to_grid | Innermost | 0.06 | 0.81 | 0.81 | 1 | 0.86 | 0 | 25 | 1 | 2.29 | 4 | 1 | 0 | 0 | 0 | 2 | 0 |
116350 | cp2k.ssmp - pw_methods.F:644-644 | pw_derive | Single | 0.06 | 0.81 | 0.81 | 1 | 0.78 | 57.14 | 53.57 | 1 | 1 | 1.6 | 1 | 0 | 2 | 0 | 2 | 0 |
164705 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.06 | 0.82 | 0.82 | 1 | 5.47 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 3 | 0 | 0 | 0 |
95324 | cp2k.ssmp - grid_ref_collint.h:1107-1123 [...] | cab_to_grid | InBetween | 0.05 | 0.69 | 0.69 | 1 | 2.13 | 0 | 16.53 | 1 | 1 | 7.04 | 1 | NA | NA | NA | NA | NA |
62419 | cp2k.ssmp - core_ppl.F:516-516 | build_core_ppl | Innermost | 0.05 | 0.64 | 0.64 | 1 | 1.29 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
95323 | cp2k.ssmp - grid_ref_collint.h:1106-1123 [...] | cab_to_grid | InBetween | 0.05 | 0.64 | 0.64 | 1 | 2.29 | 0 | 17.13 | 1 | 1 | 6.18 | 1 | NA | NA | NA | NA | NA |
98415 | cp2k.ssmp - dbcsr_vector.F:1128-1129 | dbcsr_sym_matrix_vector_mult_d | InBetween | 0.05 | 0.64 | 0.64 | 1 | 0.51 | 0 | 25 | 5.25 | 2.24 | 4 | 1 | NA | NA | NA | NA | NA |
17395 | cp2k.ssmp - core_ppnl.F:529-532 | build_core_ppnl | Innermost | 0.05 | 0.74 | 0.74 | 1 | 0.65 | 0 | 12.96 | 1.49 | 1.13 | 8 | 1 | 0.67 | 0 | 0 | 1 | 0 |
210004 | cp2k.ssmp - | mkl_blas_def_dgemm_copyan_bdz | Outermost | 0.05 | 0.67 | 0.67 | 1 | 3.52 | 0 | 21.75 | 1 | 1 | 4.12 | 1 | 0 | 0.5 | 0.25 | 1.5 | 0 |
115492 | cp2k.ssmp - ao_util.F:161-175 | exp_radius_very_extended | InBetween | 0.05 | 0.64 | 0.64 | 1 | 1.15 | 19.61 | 28.19 | 1.02 | 1.02 | 4.09 | 1 | NA | NA | NA | NA | NA |
62380 | cp2k.ssmp - core_ppl.F:185-530 [...] | build_core_ppl | InBetween | 0.05 | 0.72 | 0.72 | 1 | 0.68 | 3.42 | 25.51 | 9.55 | 1 | 6.06 | 1 | NA | NA | NA | NA | NA |
242798 | cp2k.ssmp - | mkl_dft_def_ownscDftFwd_Fact5_64fc | Outermost | 0.05 | 0.74 | 0.74 | 1 | 7.08 | 94 | 48.5 | 1 | 1.4 | 2 | 1 | 1 | 0 | 11 | 0 | 0 |
165006 | cp2k.ssmp - | mkl_serv_allocate | Single | 0.05 | 0.65 | 0.65 | 1 | 4.02 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 0.25 | 0.75 | 0 | 0.25 |
164691 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | InBetween | 0.05 | 0.71 | 0.71 | 1 | 0.48 | 23.61 | 30.73 | 1.98 | 2.2 | 5.6 | 1 | NA | NA | NA | NA | NA |
139599 | cp2k.ssmp - | mkl_xomatcopy2_rec_t_1 | Innermost | 0.04 | 0.5 | 0.5 | 1 | 0.03 | 0 | 25 | 1 | 1.5 | 6 | 1 | 0 | 0 | 0 | 4 | 0 |
95285 | cp2k.ssmp - grid_ref_collint.h:1106-1121 [...] | grid_ref_collocate_pgf_product | InBetween | 0.04 | 0.58 | 0.58 | 1 | 1.20 | 0 | 17.5 | 1 | 1 | 6 | 1 | NA | NA | NA | NA | NA |
114354 | cp2k.ssmp - ai_oneelectron.F:450-465 | os_3center | InBetween | 0.04 | 0.57 | 0.57 | 1 | 0.33 | 2.38 | 25 | 7.21 | 1 | 6 | 1 | NA | NA | NA | NA | NA |
62437 | cp2k.ssmp - core_ppl.F:371-371 | build_core_ppl | Innermost | 0.04 | 0.62 | 0.62 | 1 | 0.17 | 14.29 | 26.79 | 1 | 1 | 4.89 | 1 | 1 | 0 | 0 | 0 | 0 |
114391 | cp2k.ssmp - ai_oneelectron.F:227-411 [...] | os_3center | InBetween | 0.04 | 0.58 | 0.58 | 1 | 0.40 | 5.26 | 25.36 | 8.54 | 2.24 | 6.84 | 1 | NA | NA | NA | NA | NA |
164662 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Outermost | 0.04 | 0.57 | 0.57 | 1 | 2.49 | 13.98 | 28.49 | 3.25 | 2.39 | 3.99 | 1 | NA | NA | NA | NA | NA |
109817 | cp2k.ssmp - xc.F:1219-1219 | xc_vxc_pw_create | Innermost | 0.04 | 0.52 | 0.52 | 1 | 0.80 | 50 | 37.5 | 1 | 1 | 3 | 1 | 0 | 1 | 2 | 2 | 0 |
269267 | cp2k.ssmp - | for_check_mult_overflow64 | Single | 0.04 | 0.57 | 0.57 | 1 | 0.44 | 0 | 21.44 | 1 | 1 | 5.76 | 1 | 1 | 0 | 0 | 1 | 0 |
95286 | cp2k.ssmp - grid_ref_collint.h:1107-1121 [...] | grid_ref_collocate_pgf_product | InBetween | 0.04 | 0.55 | 0.55 | 1 | 1.22 | 0 | 16.29 | 1 | 1 | 7.03 | 1 | NA | NA | NA | NA | NA |
126115 | cp2k.ssmp - kahan_sum.F:232-236 | kahan_sum_z1 | Single | 0.04 | 0.61 | 0.61 | 1 | 2.11 | 100 | 50 | 1 | 1.82 | 2 | 1 | 0 | 1 | 0 | 0 | 0 |
162357 | cp2k.ssmp - | mkl_blas_mc_cgemm_pst | Single | 0.04 | 0.53 | 0.53 | 1 | 2.57 | 96.97 | 49.24 | 1 | 1 | 2 | 1 | 0 | 0 | 0 | 2 | 0 |
95319 | cp2k.ssmp - grid_ref_collint.h:1103-1186 [...] | cab_to_grid | InBetween | 0.04 | 0.52 | 0.52 | 1 | 2.23 | 0 | 19.49 | 1 | 1.25 | 6.86 | 1 | NA | NA | NA | NA | NA |
62418 | cp2k.ssmp - core_ppl.F:516-516 | build_core_ppl | Innermost | 0.04 | 0.59 | 0.59 | 1 | 0.58 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
163862 | cp2k.ssmp - | mkl_blas_def_xdgemv | Single | 0.04 | 0.49 | 0.49 | 1 | 19.39 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 5 | 0 | 0 | 0 |
114259 | cp2k.ssmp - ai_overlap_ppl.F:154-473 [...] | ppl_integral | InBetween | 0.04 | 0.57 | 0.57 | 1 | 0.82 | 5.98 | 24.03 | 1.99 | 1.54 | 6.92 | 1 | NA | NA | NA | NA | NA |
114253 | cp2k.ssmp - ai_overlap_ppl.F:154-473 [...] | ppl_integral | InBetween | 0.04 | 0.54 | 0.54 | 1 | 0.81 | 11.71 | 27.93 | 1.43 | 1.43 | 3.82 | 1 | NA | NA | NA | NA | NA |
163832 | cp2k.ssmp - | mkl_blas_def_xdgemv | Outermost | 0.04 | 0.59 | 0.59 | 1 | 1.28 | 21.05 | 30.04 | 2 | 2.23 | 5.73 | 1 | NA | NA | NA | NA | NA |
98377 | cp2k.ssmp - dbcsr_vector.F:1115-1142 | dbcsr_sym_matrix_vector_mult_d | Outermost | 0.04 | 0.62 | 0.62 | 1 | 0.49 | 5.24 | 25.57 | 10 | 1.11 | 9.14 | 1 | NA | NA | NA | NA | NA |
62406 | cp2k.ssmp - core_ppl.F:522-522 | build_core_ppl | Innermost | 0.04 | 0.55 | 0.55 | 1 | 1.20 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 1 | 0 |
116640 | cp2k.ssmp - pw_methods.F:2253-2253 | pw_integral_ab#omp_region_14 | Single | 0.03 | 0.35 | 0.35 | 1 | 2.71 | 100 | 88.89 | 1 | 1 | 1.14 | 1 | 0 | 2 | 1 | 0 | 0 |
209974 | cp2k.ssmp - | mkl_blas_def_xdgemm_bdz | Innermost | 0.03 | 0.45 | 0.44 | 1 | 5.35 | 0 | 23.61 | 1 | 1 | 5.87 | 1 | 3 | 0 | 0 | 2 | 0 |
162364 | cp2k.ssmp - | mkl_blas_mc_cgemm_pst | Single | 0.03 | 0.36 | 0.37 | 1 | 2.40 | 96 | 49 | 1 | 1 | 2 | 1 | 0 | 0 | 0 | 2 | 0 |
62439 | cp2k.ssmp - core_ppl.F:352-366 | build_core_ppl | InBetween | 0.03 | 0.48 | 0.47 | 1 | 0.92 | 3.57 | 26.24 | 4.95 | 1.07 | 5.73 | 1 | NA | NA | NA | NA | NA |
18105 | cp2k.ssmp - qs_overlap.F:433-484 | build_overlap_matrix_low | InBetween | 0.03 | 0.38 | 0.38 | 1 | 0.52 | 2.44 | 24.78 | 20.33 | 2.33 | 10.47 | 1 | NA | NA | NA | NA | NA |
95283 | cp2k.ssmp - grid_ref_collint.h:1059-1121 [...] | grid_ref_collocate_pgf_product | InBetween | 0.03 | 0.42 | 0.42 | 1 | 1.60 | 0 | 17.86 | 1 | 1.52 | 9.91 | 1 | NA | NA | NA | NA | NA |
130125 | cp2k.ssmp - dbcsr_toollib.F:226-236 | ordered_search | Single | 0.03 | 0.43 | 0.43 | 1 | 0.69 | 0 | 12.5 | 1 | 1 | 8 | 1 | 0 | 0 | 0 | 1 | 0 |
95281 | cp2k.ssmp - grid_ref_collint.h:1103-1121 [...] | grid_ref_collocate_pgf_product | InBetween | 0.03 | 0.46 | 0.46 | 1 | 1.44 | 0 | 19.7 | 1 | 1.15 | 6.35 | 1 | NA | NA | NA | NA | NA |
95320 | cp2k.ssmp - grid_ref_collint.h:1102-1186 [...] | cab_to_grid | InBetween | 0.03 | 0.42 | 0.43 | 1 | 2.20 | 0 | 20.19 | 1 | 1.47 | 7.72 | 1 | NA | NA | NA | NA | NA |
95331 | cp2k.ssmp - grid_ref_collint.h:1070-1080 | cab_to_grid | InBetween | 0.03 | 0.4 | 0.4 | 1 | 2.08 | 18.75 | 24.22 | 1 | 2.89 | 4 | 1 | NA | NA | NA | NA | NA |
31910 | cp2k.ssmp - qs_ks_utils.F:1294-1294 | sum_up_and_integrate | Innermost | 0.03 | 0.37 | 0.37 | 1 | 0.00 | 0 | 25 | 1 | 1 | 4 | 1 | 1 | 1 | 0 | 1 | 0 |
95282 | cp2k.ssmp - grid_ref_collint.h:1102-1121 [...] | grid_ref_collocate_pgf_product | InBetween | 0.03 | 0.41 | 0.41 | 1 | 1.36 | 0 | 20.19 | 1 | 1.47 | 7.72 | 1 | NA | NA | NA | NA | NA |
116429 | cp2k.ssmp - pw_methods.F:114-114 | pw_zero | Single | 0.03 | 0.35 | 0.35 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 1 | 0 | 0 | 0 |
62392 | cp2k.ssmp - core_ppl.F:526-526 | build_core_ppl | Innermost | 0.03 | 0.44 | 0.44 | 1 | 0.90 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 1 | 0 |
95325 | cp2k.ssmp - grid_ref_collint.h:1111-1123 | cab_to_grid | InBetween | 0.03 | 0.38 | 0.38 | 1 | 2.30 | 0 | 15.63 | 1 | 1 | 7.2 | 1 | NA | NA | NA | NA | NA |
137178 | cp2k.ssmp - dbcsr_block_operations.F:1641-1642 | block_partial_copy_2d1d_d | Innermost | 0.03 | 0.43 | 0.43 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
163807 | cp2k.ssmp - | mkl_blas_def_xdgemv | Outermost | 0.03 | 0.35 | 0.35 | 1 | 1.96 | 28.13 | 31.64 | 3 | 2.3 | 5.68 | 1 | NA | NA | NA | NA | NA |
98418 | cp2k.ssmp - dbcsr_vector.F:1129-1129 | dbcsr_sym_matrix_vector_mult_d | InBetween | 0.03 | 0.42 | 0.42 | 1 | 0.74 | 0 | 23.96 | 1 | 1.23 | 5.49 | 1 | NA | NA | NA | NA | NA |
163861 | cp2k.ssmp - | mkl_blas_def_xdgemv | Single | 0.03 | 0.42 | 0.42 | 1 | 29.88 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 5 | 0 | 0 | 0 |
270873 | cp2k.ssmp - | __intel_avx_rep_memset | Single | 0.03 | 0.45 | 0.45 | 1 | 0.76 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 1 | 0 | 0 | 0 |
114326 | cp2k.ssmp - ai_oneelectron.F:515-530 | os_3center | InBetween | 0.03 | 0.48 | 0.49 | 1 | 0.70 | 1.68 | 24.19 | 3.81 | 1 | 9.63 | 1 | NA | NA | NA | NA | NA |
68218 | cp2k.ssmp - qs_kinetic.F:404-452 | build_kinetic_matrix_low | InBetween | 0.03 | 0.36 | 0.37 | 1 | 0.57 | 1.71 | 24.41 | 23 | 2.33 | 10.58 | 1 | NA | NA | NA | NA | NA |
163852 | cp2k.ssmp - | mkl_blas_def_xdgemv | Single | 0.03 | 0.35 | 0.35 | 1 | 13.19 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
114415 | cp2k.ssmp - ai_oneelectron.F:178-337 [...] | os_3center | InBetween | 0.03 | 0.45 | 0.46 | 1 | 0.67 | 0 | 21.76 | 1 | 1.09 | 5.26 | 1 | 1 | 0 | 1 | 5 | 0 |
95321 | cp2k.ssmp - grid_ref_collint.h:1059-1186 [...] | cab_to_grid | InBetween | 0.03 | 0.47 | 0.47 | 1 | 1.99 | 0 | 16.81 | 1 | 1.46 | 10.16 | 1 | NA | NA | NA | NA | NA |
163853 | cp2k.ssmp - | mkl_blas_def_xdgemv | Single | 0.03 | 0.36 | 0.37 | 1 | 11.08 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 2 | 0 | 0 | 0 |
114139 | cp2k.ssmp - ai_overlap.F:778-921 | overlap_ab | Innermost | 0.03 | 0.39 | 0.39 | 1 | 0.51 | 14.14 | 28.16 | 1.51 | 1.41 | 4.74 | 1 | NA | NA | NA | NA | NA |
209971 | cp2k.ssmp - | mkl_blas_def_xdgemm_bdz | Single | 0.03 | 0.35 | 0.35 | 1 | 15.83 | 0 | 23.82 | 1 | 1 | 7.06 | 1 | 1 | 0.5 | 1 | 1 | 0 |
139597 | cp2k.ssmp - | mkl_xomatcopy2_rec_t_1 | Single | 0.02 | 0.22 | 0.21 | 1 | 0.01 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 0 | 1 | 0 | 0 |
114355 | cp2k.ssmp - ai_oneelectron.F:449-465 | os_3center | InBetween | 0.02 | 0.26 | 0.26 | 1 | 0.40 | 2 | 23.25 | 20 | 1.43 | 7.06 | 1 | NA | NA | NA | NA | NA |
164672 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.02 | 0.27 | 0.27 | 1 | 2.64 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 5 | 0 | 0 | 0 |
114252 | cp2k.ssmp - ai_overlap_ppl.F:152-473 [...] | ppl_integral | Outermost | 0.02 | 0.26 | 0.26 | 1 | 0.48 | 0 | 22.66 | 3.33 | 1.3 | 5.33 | 1 | NA | NA | NA | NA | NA |
209994 | cp2k.ssmp - | mkl_blas_def_dgemm_kernel_zen | Outermost | 0.02 | 0.21 | 0.21 | 1 | 9.36 | 0 | 25 | 1 | 1 | 4 | 1 | 1 | 6 | 0 | 0 | 0 |
135534 | cp2k.ssmp - dbcsr_mm_cannon.F:675-688 | make_images | Innermost | 0.02 | 0.26 | 0.27 | 1 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1 | 1 | 0 | 5 | 8 | 0 |
115491 | cp2k.ssmp - ao_util.F:110-290 [...] | exp_radius_very_extended | Outermost | 0.02 | 0.25 | 0.25 | 1 | 0.86 | 14.17 | 25.69 | 1.19 | 1.19 | 4.84 | 1 | NA | NA | NA | NA | NA |
98426 | cp2k.ssmp - dbcsr_vector.F:1129-1129 | dbcsr_sym_matrix_vector_mult_d | InBetween | 0.02 | 0.33 | 0.33 | 1 | 0.60 | 16.67 | 30.21 | 2.87 | 1 | 6.22 | 1 | NA | NA | NA | NA | NA |
164693 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.02 | 0.22 | 0.22 | 1 | 1.70 | 100 | 50 | 1 | 1.2 | 2 | 1 | 0 | 5 | 0 | 0 | 0 |
95296 | cp2k.ssmp - grid_ref_collint.h:1070-1080 | grid_ref_collocate_pgf_product | InBetween | 0.02 | 0.29 | 0.29 | 1 | 1.82 | 18.75 | 24.22 | 1 | 2.6 | 4 | 1 | NA | NA | NA | NA | NA |
113260 | cp2k.ssmp - ai_contraction.F:141-141 | contraction_ab | InBetween | 0.02 | 0.28 | 0.28 | 1 | 0.45 | 0 | 25 | 3.22 | 1 | 4 | 1 | NA | NA | NA | NA | NA |
114293 | cp2k.ssmp - ai_oneelectron.F:170-579 [...] | os_3center | Outermost | 0.02 | 0.21 | 0.21 | 1 | 0.68 | 0 | 24.26 | 5 | 1.58 | 5.81 | 1 | NA | NA | NA | NA | NA |
119823 | cp2k.ssmp - realspace_grid_types.F:1926-1932 | rs_grid_zero#omp_loop_0 | Single | 0.02 | 0.21 | 0.21 | 1 | 0.00 | 0 | 25 | 1 | 1 | 4 | 1 | 1 | 0 | 1 | 0 | 0 |
41084 | cp2k.ssmp - task_list_methods.F:2962-2989 | tasks_sort_low | Single | 0.02 | 0.22 | 0.22 | 1 | 0.00 | 46.15 | 46.63 | 2.33 | 1 | 1.4 | 1 | NA | NA | NA | NA | NA |
17717 | cp2k.ssmp - core_ppnl.F:559-559 | build_core_ppnl | Innermost | 0.02 | 0.22 | 0.22 | 1 | 2.39 | 0 | 25 | 1 | 2.11 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
62626 | cp2k.ssmp - core_ppl.F:435-497 [...] | build_core_ppl | InBetween | 0.02 | 0.31 | 0.31 | 1 | 0.32 | 0 | 25 | 1.75 | 1.75 | 4 | 1 | NA | NA | NA | NA | NA |
95260 | cp2k.ssmp - grid_ref_collint.h:450-452 [...] | ortho_cxyz_to_grid | Innermost | 0.02 | 0.24 | 0.24 | 1 | 1.92 | 100 | 100 | 1.38 | 1 | 1 | 1 | 1 | 1 | 0 | 0 | 0 |
114394 | cp2k.ssmp - ai_oneelectron.F:240-411 [...] | os_3center | InBetween | 0.02 | 0.26 | 0.26 | 1 | 0.57 | 1.28 | 23.08 | 5.59 | 1.82 | 6.1 | 1 | NA | NA | NA | NA | NA |
116230 | cp2k.ssmp - pw_poisson_methods.F:309-309 | pw_poisson_solve | Single | 0.02 | 0.29 | 0.29 | 1 | 3.36 | 100 | 88.89 | 1 | 1 | 1.14 | 1 | 0 | 1 | 1 | 0 | 0 |
17701 | cp2k.ssmp - core_ppnl.F:561-561 | build_core_ppnl | Innermost | 0.02 | 0.24 | 0.24 | 1 | 1.90 | 0 | 25 | 1 | 2.11 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
171170 | cp2k.ssmp - | mkl_dft_def_scatter_z_z | Single | 0.02 | 0.34 | 0.34 | 1 | 8.04 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 0 | 8 | 1 | 0 |
163858 | cp2k.ssmp - | mkl_blas_def_xdgemv | Innermost | 0.02 | 0.32 | 0.32 | 1 | 24.73 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 3 | 0 | 0 | 0 |
114270 | cp2k.ssmp - ai_overlap_ppl.F:148-148 | ppl_integral | Outermost | 0.02 | 0.23 | 0.23 | 1 | 0.48 | 3.57 | 26.34 | 3.27 | 1 | 5.57 | 1 | NA | NA | NA | NA | NA |
131492 | cp2k.ssmp - dbcsr_operations.F:2298-2298 | dbcsr_maxabs | Innermost | 0.02 | 0.28 | 0.28 | 1 | 0.00 | NA | NA | 1 | NA | NA | 1 | 0 | 0 | 2 | 0 | 0 |
171169 | cp2k.ssmp - | mkl_dft_def_scatter_z_z | Single | 0.02 | 0.26 | 0.26 | 1 | 8.95 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 0 | 8 | 1 | 0 |
17394 | cp2k.ssmp - core_ppnl.F:173-646 [...] | build_core_ppnl | InBetween | 0.02 | 0.27 | 0.27 | 1 | 1.04 | 7.14 | 28.22 | 19.77 | 2.26 | 1.24 | 1 | NA | NA | NA | NA | NA |
114295 | cp2k.ssmp - ai_oneelectron.F:566-570 | os_3center | InBetween | 0.02 | 0.27 | 0.27 | 1 | 0.68 | 0 | 24.05 | 3.42 | 1.6 | 5.66 | 1 | NA | NA | NA | NA | NA |
163857 | cp2k.ssmp - | mkl_blas_def_xdgemv | Innermost | 0.02 | 0.23 | 0.23 | 1 | 34.71 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 3 | 0 | 0 | 0 |
95287 | cp2k.ssmp - grid_ref_collint.h:1111-1121 | grid_ref_collocate_pgf_product | InBetween | 0.02 | 0.26 | 0.26 | 1 | 1.26 | 0 | 15.97 | 1 | 1 | 6.4 | 1 | NA | NA | NA | NA | NA |
171168 | cp2k.ssmp - | mkl_dft_def_scatter_z_z | Single | 0.02 | 0.27 | 0.27 | 1 | 10.25 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 0 | 8 | 1 | 0 |
135610 | cp2k.ssmp - dbcsr_mm_cannon.F:1958-2031 [...] | prepare_buffers_d | InBetween | 0.02 | 0.3 | 0.3 | 1 | 0.00 | 4.41 | 24.75 | 5.21 | 1 | 1.23 | 1 | NA | NA | NA | NA | NA |
95236 | cp2k.ssmp - grid_ref_collint.h:449-452 [...] | ortho_cxyz_to_grid | Outermost | 0.02 | 0.31 | 0.31 | 1 | 1.34 | 2.44 | 17.07 | 3.44 | 1 | 1.48 | 1 | NA | NA | NA | NA | NA |
114359 | cp2k.ssmp - ai_oneelectron.F:462-465 | os_3center | Innermost | 0.02 | 0.23 | 0.23 | 1 | 0.31 | 33.33 | 33.33 | 1.13 | 1.13 | 3.78 | 1 | 1 | 0 | 0 | 3 | 0 |
114908 | cp2k.ssmp - ai_kinetic.F:59-216 [...] | kinetic | InBetween | 0.02 | 0.32 | 0.32 | 1 | 0.52 | 20.42 | 28.21 | 2.98 | 1.95 | 5.63 | 1 | NA | NA | NA | NA | NA |
130694 | cp2k.ssmp - dbcsr_array_sort.F:120-130 | dbcsr_1d_i8_sort_low | Single | 0.02 | 0.21 | 0.21 | 1 | 0.00 | 0 | 21.96 | 1 | 1 | 6.24 | 1 | 0.5 | 3 | 0 | 2 | 0 |
95317 | cp2k.ssmp - grid_ref_collint.h:1063-1188 [...] | cab_to_grid | Outermost | 0.02 | 0.27 | 0.27 | 1 | 1.40 | 8.57 | 21.43 | 2.41 | 1.57 | 6.4 | 1 | NA | NA | NA | NA | NA |
209972 | cp2k.ssmp - | mkl_blas_def_xdgemm_bdz | Outermost | 0.02 | 0.28 | 0.28 | 1 | 7.92 | 0 | 23.96 | 1 | 1 | 5.52 | 1 | NA | NA | NA | NA | NA |
41209 | cp2k.ssmp - task_list_methods.F:2695-2695 | rs_copy_to_matrices | Innermost | 0.02 | 0.26 | 0.26 | 1 | 0.59 | 0 | 25 | 1.5 | 1.33 | 4 | 1 | 1 | 2 | 0 | 0 | 0 |
95229 | cp2k.ssmp - grid_ref_collint.h:450-452 [...] | ortho_cxyz_to_grid#0x25f0030 | Innermost | 0.02 | 0.23 | 0.23 | 1 | 1.73 | 100 | 100 | 1.38 | 1 | 1 | 1 | 1 | 1 | 0 | 0 | 0 |
113230 | cp2k.ssmp - ai_contraction.F:147-147 | contraction_ab | Innermost | 0.02 | 0.25 | 0.25 | 1 | 0.58 | 0 | 25 | 1.17 | 1.17 | 4 | 1 | 0 | 1 | 0 | 1 | 0 |
62454 | cp2k.ssmp - core_ppl.F:364-364 | build_core_ppl | Innermost | 0.02 | 0.24 | 0.24 | 1 | 1.34 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
98543 | cp2k.ssmp - dbcsr_vector.F:338-652 [...] | dbcsr_matrix_vector_mult_d | Outermost | 0.02 | 0.31 | 0.31 | 1 | 0.67 | 1.69 | 22.49 | 1 | 1.44 | 10.52 | 1 | NA | NA | NA | NA | NA |
17683 | cp2k.ssmp - core_ppnl.F:564-564 | build_core_ppnl | Innermost | 0.02 | 0.23 | 0.23 | 1 | 1.90 | 0 | 25 | 1 | 2.11 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
169527 | cp2k.ssmp - | mkl_trans_def_dsqtrans_fit_64 | Single | 0.02 | 0.21 | 0.21 | 1 | 0.00 | 0 | 25 | 1 | 1.48 | 5.92 | 1 | 0 | 0 | 0 | 8 | 0 |
116314 | cp2k.ssmp - pw_methods.F:350-350 | pw_scale | Innermost | 0.02 | 0.3 | 0.3 | 1 | 1.91 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 0 | 2 | 0 | 0 |
171171 | cp2k.ssmp - | mkl_dft_def_scatter_z_z | Single | 0.02 | 0.28 | 0.28 | 1 | 9.50 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 0 | 8 | 1 | 0 |
114333 | cp2k.ssmp - ai_oneelectron.F:489-493 | os_3center | InBetween | 0.02 | 0.32 | 0.32 | 1 | 0.33 | 0 | 24.13 | 3.54 | 1.59 | 5.62 | 1 | NA | NA | NA | NA | NA |
114903 | cp2k.ssmp - ai_kinetic.F:59-226 [...] | kinetic | InBetween | 0.02 | 0.24 | 0.24 | 1 | 0.42 | 14.44 | 28.13 | 2.69 | 1.82 | 6.08 | 1 | NA | NA | NA | NA | NA |
95203 | cp2k.ssmp - grid_ref_collint.h:449-452 [...] | ortho_cxyz_to_grid#0x25f0030 | Outermost | 0.02 | 0.27 | 0.27 | 1 | 1.55 | 2.44 | 17.07 | 3.44 | 1 | 1.48 | 1 | NA | NA | NA | NA | NA |
242781 | cp2k.ssmp - | mkl_dft_def_ownscDftFwd_Fact3_64fc | Innermost | 0.01 | 0.16 | 0.17 | 1 | 5.38 | 61.9 | 40.48 | 1 | 1.17 | 2.55 | 1 | 1 | 6 | 1 | 0 | 0 |
18102 | cp2k.ssmp - qs_overlap.F:334-487 | build_overlap_matrix_low | InBetween | 0.01 | 0.07 | 0.07 | 1 | 0.36 | 47.14 | 55.92 | 1.84 | 2.26 | 1.52 | 1 | NA | NA | NA | NA | NA |
114409 | cp2k.ssmp - ai_oneelectron.F:240-245 | os_3center | Innermost | 0.01 | 0.15 | 0.16 | 1 | 0.37 | 47.37 | 36.84 | 1 | 1.08 | 3.25 | 1 | 0 | 0 | 0 | 3 | 0 |
114353 | cp2k.ssmp - ai_oneelectron.F:437-465 [...] | os_3center | InBetween | 0.01 | 0.12 | 0.12 | 1 | 0.47 | 0 | 22.73 | 10.86 | 1.39 | 7.24 | 1 | NA | NA | NA | NA | NA |
95364 | cp2k.ssmp - grid_ref_task_list.c:195-592 [...] | grid_ref_integrate_task_list | InBetween | 0.01 | 0.17 | 0.18 | 1 | 1.62 | 14.68 | 30.73 | 1.6 | 1.35 | 1.79 | 1 | NA | NA | NA | NA | NA |
114916 | cp2k.ssmp - ai_kinetic.F:177-211 [...] | kinetic | Innermost | 0.01 | 0.15 | 0.15 | 1 | 0.47 | 6.33 | 26.02 | 1 | 2.07 | 4 | 1 | 1 | 0 | 2 | 9 | 0 |
113250 | cp2k.ssmp - ai_contraction.F:144-144 | contraction_ab | Innermost | 0.01 | 0.1 | 0.1 | 1 | 1.09 | 0 | 25 | 1.17 | 1.17 | 4 | 1 | 0 | 1 | 0 | 1 | 0 |
136427 | cp2k.ssmp - dbcsr_block_operations.F:430-430 | dbcsr_block_scale | Innermost | 0.01 | 0.08 | 0.08 | 1 | 0.84 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 1 | 0 | 0 | 0 |
62433 | cp2k.ssmp - core_ppl.F:371-516 [...] | build_core_ppl | InBetween | 0.01 | 0.2 | 0.2 | 1 | 0.27 | 6.67 | 27.92 | 3.83 | 1 | 5.13 | 1 | NA | NA | NA | NA | NA |
62405 | cp2k.ssmp - core_ppl.F:522-522 | build_core_ppl | InBetween | 0.01 | 0.13 | 0.13 | 1 | 1.23 | 0 | 21.39 | 2.8 | 1 | 5.21 | 1 | 1 | 0.5 | 0 | 1 | 0 |
62421 | cp2k.ssmp - core_ppl.F:516-516 | build_core_ppl | InBetween | 0.01 | 0.16 | 0.16 | 1 | 0.59 | 27.27 | 35.23 | 2.93 | 1 | 6.27 | 1 | NA | NA | NA | NA | NA |
162780 | cp2k.ssmp - | mkl_blas_def_xdgemmger | Outermost | 0.01 | 0.11 | 0.11 | 1 | 2.02 | 12 | 27 | 2.2 | 2.36 | 6.43 | 1 | NA | NA | NA | NA | NA |
110588 | cp2k.ssmp - xc_rho_set_types.F:777-781 | xc_rho_set_update | Innermost | 0.01 | 0.2 | 0.2 | 1 | 4.58 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 4 | 0 | 0 | 0 |
114264 | cp2k.ssmp - ai_overlap_ppl.F:453-453 | ppl_integral | Innermost | 0.01 | 0.08 | 0.08 | 1 | 0.73 | 0 | 12.5 | 1 | 1 | 8 | 1 | NA | NA | NA | NA | NA |
163868 | cp2k.ssmp - | mkl_blas_def_xdgemv | Innermost | 0.01 | 0.1 | 0.1 | 1 | 1.14 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 9 | 0 | 0 | 0 |
41008 | cp2k.ssmp - task_list_methods.F:3003-3018 | atom_pair_sort_low | Single | 0.01 | 0.07 | 0.07 | 1 | 0.00 | 0 | 12.93 | 1 | 1 | 7.85 | 1 | NA | NA | NA | NA | NA |
98427 | cp2k.ssmp - dbcsr_vector.F:1129-1129 | dbcsr_sym_matrix_vector_mult_d | Innermost | 0.01 | 0.07 | 0.07 | 1 | 0.45 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 0 | 0 |
114254 | cp2k.ssmp - ai_overlap_ppl.F:171-171 | ppl_integral | Innermost | 0.01 | 0.07 | 0.07 | 1 | 0.30 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 0 | 0 |
114905 | cp2k.ssmp - ai_kinetic.F:59-216 [...] | kinetic | InBetween | 0.01 | 0.11 | 0.11 | 1 | 0.31 | 0 | 21.02 | 1 | 1.06 | 6 | 1 | NA | NA | NA | NA | NA |
134856 | cp2k.ssmp - dbcsr_mm_common.F:265-271 | rec_sort_index | Single | 0.01 | 0.15 | 0.15 | 1 | 0.00 | 0 | 13.39 | 1 | 1.16 | 8.99 | 1 | 0 | 2 | 0 | 0 | 0 |
135521 | cp2k.ssmp - dbcsr_mm_cannon.F:480-505 | make_images | InBetween | 0.01 | 0.19 | 0.19 | 1 | 0.00 | 0 | 19.71 | 1 | 1.06 | 7.36 | 1 | NA | NA | NA | NA | NA |
120764 | cp2k.ssmp - pw_grids.F:1855-1859 | pw_grid_sort | Innermost | 0.01 | 0.14 | 0.14 | 1 | 0.75 | 17.11 | 28.05 | 1 | 3.3 | 4 | 1 | 3.25 | 0 | 0 | 2.5 | 0 |
62378 | cp2k.ssmp - core_ppl.F:185-531 [...] | build_core_ppl | InBetween | 0.01 | 0.08 | 0.08 | 1 | 0.52 | 0 | 22.37 | 1 | 1 | 5.87 | 1 | NA | NA | NA | NA | NA |
114330 | cp2k.ssmp - ai_oneelectron.F:527-530 | os_3center | Innermost | 0.01 | 0.08 | 0.08 | 1 | 1.42 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 9 | 0 | 0 | 0 |
98429 | cp2k.ssmp - dbcsr_vector.F:1122-1123 | dbcsr_sym_matrix_vector_mult_d | InBetween | 0.01 | 0.12 | 0.12 | 1 | 0.33 | 0 | 25 | 4.25 | 2.23 | 4 | 1 | NA | NA | NA | NA | NA |
113574 | cp2k.ssmp - ai_os_rr.F:91-95 | os_rr_ovlp | Innermost | 0.01 | 0.07 | 0.07 | 1 | 0.21 | 4 | 24.5 | 1 | 1.33 | 4 | 1 | 0 | 6 | 3 | 0 | 0 |
26503 | cp2k.ssmp - qs_neighbor_lists.F:1096-1362 [...] | build_neighbor_lists | InBetween | 0.01 | 0.13 | 0.13 | 1 | 0.27 | 17.89 | 27.27 | 3.04 | 2.15 | 9.02 | 1 | NA | NA | NA | NA | NA |
113310 | cp2k.ssmp - ai_contraction.F:353-353 | decontraction_ab | Innermost | 0.01 | 0.12 | 0.12 | 1 | 0.49 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
98431 | cp2k.ssmp - dbcsr_vector.F:1122-1122 | dbcsr_sym_matrix_vector_mult_d | Innermost | 0.01 | 0.1 | 0.1 | 1 | 0.90 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 2 | 0 | 0 |
62391 | cp2k.ssmp - core_ppl.F:526-526 | build_core_ppl | InBetween | 0.01 | 0.14 | 0.15 | 1 | 0.84 | 0 | 21.88 | 2.27 | 1 | 6.45 | 1 | 0.5 | 0 | 0 | 1.5 | 0 |
62486 | cp2k.ssmp - core_ppl.F:357-357 | build_core_ppl | Innermost | 0.01 | 0.07 | 0.07 | 1 | 2.27 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
211191 | cp2k.ssmp - | mkl_blas_def_dtrsm_i | Innermost | 0.01 | 0.14 | 0.14 | 1 | 4.66 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 2 | 0 | 0 | 0 |
114136 | cp2k.ssmp - ai_overlap.F:772-924 | overlap_ab | InBetween | 0.01 | 0.11 | 0.11 | 1 | 0.38 | 4.76 | 23.21 | 5.08 | 1.27 | 5.08 | 1 | NA | NA | NA | NA | NA |
41197 | cp2k.ssmp - task_list_methods.F:2649-2649 | rs_copy_to_buffer | Innermost | 0.01 | 0.09 | 0.09 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
114387 | cp2k.ssmp - ai_oneelectron.F:333-347 | os_3center | InBetween | 0.01 | 0.11 | 0.11 | 1 | 0.34 | 0 | 18.38 | 1 | 1 | 6.59 | 1 | NA | NA | NA | NA | NA |
41215 | cp2k.ssmp - task_list_methods.F:2695-2695 | rs_copy_to_matrices | Innermost | 0.01 | 0.09 | 0.09 | 1 | 0.51 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
114913 | cp2k.ssmp - ai_kinetic.F:177-185 | kinetic | Innermost | 0.01 | 0.09 | 0.09 | 1 | 0.35 | 0 | 25 | 1.24 | 1.82 | 4 | 1 | 1 | 4 | 0 | 2 | 0 |
62411 | cp2k.ssmp - core_ppl.F:516-516 | build_core_ppl | Innermost | 0.01 | 0.07 | 0.07 | 1 | 1.02 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
62456 | cp2k.ssmp - core_ppl.F:364-364 | build_core_ppl | InBetween | 0.01 | 0.07 | 0.07 | 1 | 0.73 | 16.67 | 32.29 | 1.8 | 1 | 6.52 | 1 | NA | NA | NA | NA | NA |
95369 | cp2k.ssmp - grid_ref_prepare_pab.c:50-63 [...] | grid_ref_prepare_pab | InBetween | 0.01 | 0.12 | 0.12 | 1 | 1.49 | 0 | 12.5 | 1 | 1 | 8 | 1 | NA | NA | NA | NA | NA |
113264 | cp2k.ssmp - ai_contraction.F:141-141 | contraction_ab | Innermost | 0.01 | 0.18 | 0.18 | 1 | 0.60 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
95266 | cp2k.ssmp - grid_ref_collint.h:953-1179 [...] | grid_ref_collocate_pgf_product | Outermost | 0.01 | 0.09 | 0.09 | 1 | 2.74 | 10.26 | 23.08 | 2.24 | 1.85 | 6.23 | 1 | NA | NA | NA | NA | NA |
113385 | cp2k.ssmp - ai_contraction.F:395-395 | force_trace_ab | Innermost | 0.01 | 0.14 | 0.14 | 1 | 0.59 | 0 | 25 | 1 | 2.2 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
95299 | cp2k.ssmp - grid_ref_integrate.c:60-121 [...] | grid_ref_integrate_pgf_product | InBetween | 0.01 | 0.1 | 0.1 | 1 | 1.55 | 0 | 15.63 | 1 | 1.64 | 11.08 | 1 | NA | NA | NA | NA | NA |
136998 | cp2k.ssmp - dbcsr_block_operations.F:1485-1486 | block_partial_copy_d | Innermost | 0.01 | 0.1 | 0.1 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
171166 | cp2k.ssmp - | mkl_dft_def_scatter_z_z | Innermost | 0.01 | 0.1 | 0.1 | 1 | 7.11 | 0 | 25 | 1 | 1.5 | 6 | 1 | 0 | 1 | 0 | 4 | 0 |
98438 | cp2k.ssmp - dbcsr_vector.F:1123-1123 | dbcsr_sym_matrix_vector_mult_d | Innermost | 0.01 | 0.18 | 0.18 | 1 | 0.52 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
210286 | cp2k.ssmp - | mkl_blas_def_dgemm_mscale | Outermost | 0.01 | 0.07 | 0.07 | 1 | 1.70 | 0 | 22.22 | 1 | 1 | 6.9 | 1 | NA | NA | NA | NA | NA |
114405 | cp2k.ssmp - ai_oneelectron.F:258-277 | os_3center | Innermost | 0.01 | 0.14 | 0.15 | 1 | 0.40 | 36.31 | 34.08 | 1.23 | 1.12 | 4 | 1 | 1 | 0 | 0 | 26 | 0 |
98437 | cp2k.ssmp - dbcsr_vector.F:1123-1123 | dbcsr_sym_matrix_vector_mult_d | InBetween | 0.01 | 0.2 | 0.2 | 1 | 0.54 | 0 | 25 | 2.57 | 1 | 4 | 1 | NA | NA | NA | NA | NA |
131433 | cp2k.ssmp - dbcsr_operations.F:1978-1978 | dbcsr_filter_anytype | Innermost | 0.01 | 0.17 | 0.17 | 1 | 1.76 | 0 | 25 | 1 | 2.5 | 4 | 1 | 0 | 1 | 0 | 0 | 0 |
114325 | cp2k.ssmp - ai_oneelectron.F:437-530 [...] | os_3center | InBetween | 0.01 | 0.1 | 0.1 | 1 | 0.54 | 0 | 22 | 11.33 | 1.31 | 7.42 | 1 | NA | NA | NA | NA | NA |
163836 | cp2k.ssmp - | mkl_blas_def_xdgemv | Outermost | 0.01 | 0.12 | 0.12 | 1 | 2.47 | 19.61 | 28.92 | 2.29 | 2.05 | 5.67 | 1 | NA | NA | NA | NA | NA |
115493 | cp2k.ssmp - ao_util.F:167-173 | exp_radius_very_extended | Innermost | 0.01 | 0.09 | 0.09 | 1 | 1.25 | 0 | 25 | 1.25 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
62422 | cp2k.ssmp - core_ppl.F:516-516 | build_core_ppl | Innermost | 0.01 | 0.12 | 0.12 | 1 | 0.83 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 0 | 0 |
125825 | cp2k.ssmp - routine_map.F:43-46 | routine_map_get | Single | 0.01 | 0.17 | 0.18 | 1 | 0.11 | 0 | 22.22 | 1 | 1 | 5.79 | 1 | 0 | 1 | 0 | 0 | 0 |
164663 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.01 | 0.13 | 0.13 | 1 | 2.12 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
135975 | cp2k.ssmp - dbcsr_mm_csr.F:264-808 [...] | dbcsr_mm_csr_multiply | InBetween | 0.01 | 0.16 | 0.16 | 1 | 0.61 | 0 | 23.68 | 2.75 | 1.14 | 6.14 | 1 | NA | NA | NA | NA | NA |
210287 | cp2k.ssmp - | mkl_blas_def_dgemm_mscale | Innermost | 0.01 | 0.08 | 0.08 | 1 | 3.20 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 4 | 0 | 0 | 0 |
136971 | cp2k.ssmp - dbcsr_block_operations.F:1559-1560 | block_partial_copy_1d2d_d | Innermost | 0.01 | 0.13 | 0.13 | 1 | 0.00 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
95209 | cp2k.ssmp - grid_ref_collint.h:329-343 [...] | ortho_cxyz_to_grid#0x25f0030 | Innermost | 0.01 | 0.17 | 0.17 | 1 | 2.90 | 100 | 81.82 | 1 | 1 | 1.27 | 1 | 0 | 2 | 0 | 0 | 0 |
113268 | cp2k.ssmp - ai_contraction.F:141-141 | contraction_ab | Innermost | 0.01 | 0.07 | 0.07 | 1 | 0.79 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 0 | 0 |
62448 | cp2k.ssmp - core_ppl.F:364-364 | build_core_ppl | InBetween | 0.01 | 0.09 | 0.08 | 1 | 1.27 | 0 | 24.54 | 1 | 1.01 | 5.4 | 1 | NA | NA | NA | NA | NA |
163837 | cp2k.ssmp - | mkl_blas_def_xdgemv | Innermost | 0.01 | 0.14 | 0.14 | 1 | 3.27 | 0 | 25 | 1.17 | 1.17 | 4 | 1 | 0 | 1 | 0 | 1 | 0 |
31913 | cp2k.ssmp - qs_ks_utils.F:1294-1295 | sum_up_and_integrate | Innermost | 0.01 | 0.13 | 0.13 | 1 | 2.32 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 3 | 0 | 0 | 0 |
62480 | cp2k.ssmp - core_ppl.F:357-357 | build_core_ppl | InBetween | 0.01 | 0.12 | 0.12 | 1 | 0.81 | 0 | 24.6 | 1 | 1 | 5.62 | 1 | NA | NA | NA | NA | NA |
114403 | cp2k.ssmp - ai_oneelectron.F:230-305 [...] | os_3center | Innermost | 0.01 | 0.11 | 0.11 | 1 | 0.41 | 5.11 | 27.38 | 1.9 | 1.23 | 2.3 | 1 | 1 | 0 | 0 | 5.5 | 8 |
113259 | cp2k.ssmp - ai_contraction.F:141-141 | contraction_ab | Outermost | 0.01 | 0.12 | 0.12 | 1 | 0.43 | 0 | 24.4 | 1 | 1.12 | 5.33 | 1 | NA | NA | NA | NA | NA |
114363 | cp2k.ssmp - ai_oneelectron.F:428-429 | os_3center | Innermost | 0.01 | 0.19 | 0.19 | 1 | 0.44 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
40846 | cp2k.ssmp - task_list_methods.F:698-725 [...] | task_list_inner_loop | Innermost | 0.01 | 0.1 | 0.1 | 1 | 0.74 | 0 | 24.46 | 5.43 | 2.71 | 6.38 | 1 | 4.5 | 0 | 0 | 6 | 0 |
114271 | cp2k.ssmp - ai_overlap_ppl.F:148-148 | ppl_integral | Innermost | 0.01 | 0.13 | 0.13 | 1 | 0.50 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 0 | 0 |
116494 | cp2k.ssmp - pw_methods.F:1025-1025 | pw_axpy | Innermost | 0.01 | 0.16 | 0.16 | 1 | 0.80 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 0 | 4 | 0 | 0 |
41200 | cp2k.ssmp - task_list_methods.F:2649-2649 | rs_copy_to_buffer | Innermost | 0.01 | 0.1 | 0.1 | 1 | 0.00 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
165035 | cp2k.ssmp - | mkl_serv_deallocate | Single | 0.01 | 0.08 | 0.08 | 1 | 4.64 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 1 | 0 | 0 | 0 |
113371 | cp2k.ssmp - ai_contraction.F:449-449 | block_add_ab | Innermost | 0.01 | 0.07 | 0.07 | 1 | 0.61 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
95370 | cp2k.ssmp - grid_ref_prepare_pab.c:54-63 [...] | grid_ref_prepare_pab | InBetween | 0.01 | 0.08 | 0.08 | 1 | 2.42 | 0 | 12.5 | 1 | 1 | 8 | 1 | NA | NA | NA | NA | NA |
114386 | cp2k.ssmp - ai_oneelectron.F:334-347 | os_3center | InBetween | 0.01 | 0.12 | 0.12 | 1 | 0.66 | 0 | 20.26 | 1 | 1.5 | 8.35 | 1 | NA | NA | NA | NA | NA |
127432 | cp2k.ssmp - util.F:74-79 | locate | Single | 0.01 | 0.08 | 0.08 | 1 | 0.56 | 0 | 12.5 | 1 | 1 | 8 | 1 | 0 | 0 | 0 | 1 | 0 |
113246 | cp2k.ssmp - ai_contraction.F:144-144 | contraction_ab | InBetween | 0.01 | 0.07 | 0.07 | 1 | 0.95 | 0 | 23.48 | 3.69 | 1 | 6.52 | 1 | NA | NA | NA | NA | NA |
68219 | cp2k.ssmp - qs_kinetic.F:443-452 | build_kinetic_matrix_low | Innermost | 0.01 | 0.09 | 0.08 | 1 | 0.58 | 1.49 | 23.51 | 15.2 | 1.12 | 6.18 | 1 | NA | NA | NA | NA | NA |
41087 | cp2k.ssmp - task_list_methods.F:2989-2989 | tasks_sort_low | Single | 0.01 | 0.09 | 0.09 | 1 | 0.00 | 80 | 71.67 | 1.33 | 1.33 | 1.6 | 1 | 0 | 0 | 2 | 0 | 0 |
134858 | cp2k.ssmp - dbcsr_mm_common.F:265-271 | rec_sort_index | Single | 0.01 | 0.11 | 0.11 | 1 | 0.00 | 0 | 13.39 | 1 | 1.16 | 8.99 | 1 | 0 | 2 | 0 | 0 | 0 |
68215 | cp2k.ssmp - qs_kinetic.F:305-454 | build_kinetic_matrix_low | InBetween | 0.01 | 0.09 | 0.09 | 1 | 0.82 | 50.54 | 58.74 | 1.82 | 2.16 | 1.32 | 1 | NA | NA | NA | NA | NA |
114362 | cp2k.ssmp - ai_oneelectron.F:427-429 | os_3center | InBetween | 0.01 | 0.12 | 0.12 | 1 | 0.32 | 0 | 18.27 | 1 | 1 | 7.31 | 1 | NA | NA | NA | NA | NA |
164668 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | Innermost | 0.01 | 0.11 | 0.11 | 1 | 2.63 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 3 | 0 | 0 | 0 |
62441 | cp2k.ssmp - core_ppl.F:364-364 | build_core_ppl | Innermost | 0.01 | 0.08 | 0.08 | 1 | 0.47 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
164686 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | InBetween | 0.01 | 0.07 | 0.07 | 1 | 0.41 | 36.67 | 33.75 | 2.18 | 2.37 | 5.61 | 1 | NA | NA | NA | NA | NA |
242855 | cp2k.ssmp - | mkl_dft_def_ownscDftInv_Fact3_64fc | Innermost | 0.01 | 0.16 | 0.16 | 1 | 5.80 | 61.9 | 40.48 | 1 | 1.17 | 2.55 | 1 | 1 | 6 | 1 | 0 | 0 |
62481 | cp2k.ssmp - core_ppl.F:357-357 | build_core_ppl | InBetween | 0.01 | 0.1 | 0.1 | 1 | 0.88 | 0 | 24.38 | 2.74 | 1 | 5.89 | 1 | NA | NA | NA | NA | NA |
95237 | cp2k.ssmp - grid_ref_collint.h:459-464 | ortho_cxyz_to_grid | Outermost | 0.01 | 0.07 | 0.07 | 1 | 2.46 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 0.75 | 0 | 0 | 0 |
62397 | cp2k.ssmp - core_ppl.F:520-520 | build_core_ppl | Innermost | 0.01 | 0.13 | 0.13 | 1 | 0.67 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
116400 | cp2k.ssmp - pw_methods.F:213-216 | pw_copy#omp_loop_2 | Single | 0.01 | 0.09 | 0.09 | 1 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1 | 0 | 1 | 0 | 5 | 0 |
110426 | cp2k.ssmp - xc.F:3265-3266 | divide_by_norm_drho | Innermost | 0.01 | 0.12 | 0.12 | 1 | 0.99 | 55.56 | 61.11 | 1 | 1 | 1 | 1 | 0 | 1 | 2 | 2 | 0 |
135609 | cp2k.ssmp - dbcsr_mm_cannon.F:1955-2031 [...] | prepare_buffers_d | Outermost | 0.01 | 0.07 | 0.07 | 1 | 0.00 | 16.67 | 23.96 | 1 | 1 | 7.03 | 1 | NA | NA | NA | NA | NA |
17667 | cp2k.ssmp - core_ppnl.F:566-566 | build_core_ppnl | Innermost | 0.01 | 0.15 | 0.15 | 1 | 2.94 | 0 | 25 | 1 | 2.11 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
136002 | cp2k.ssmp - dbcsr_hash_table.f90:30-34 | hash_table_add | Innermost | 0.01 | 0.08 | 0.08 | 1 | 0.05 | 0 | 12.5 | 1 | 1 | 8 | 1 | 0 | 0 | 0 | 0 | 0 |
116522 | cp2k.ssmp - pw_methods.F:1118-1121 | pw_axpy#omp_loop_19 | Single | 0.01 | 0.12 | 0.12 | 1 | 0.82 | 100 | 50 | 1 | 1.2 | 2 | 1 | 0 | 2 | 0 | 0 | 1 |
114133 | cp2k.ssmp - ai_overlap.F:745-933 [...] | overlap_ab | InBetween | 0.01 | 0.19 | 0.2 | 1 | 0.49 | 13.59 | 29.37 | 1.31 | 1.66 | 3.92 | 1 | NA | NA | NA | NA | NA |
18110 | cp2k.ssmp - qs_overlap.F:463-463 | build_overlap_matrix_low | Innermost | 0.01 | 0.11 | 0.11 | 1 | 0.18 | 10 | 26.25 | 1 | 1 | 4.79 | 1 | 1 | 0 | 0 | 0 | 0 |
62413 | cp2k.ssmp - core_ppl.F:516-516 | build_core_ppl | InBetween | 0.01 | 0.07 | 0.07 | 1 | 0.91 | 0 | 24.17 | 1 | 1.57 | 7.2 | 1 | NA | NA | NA | NA | NA |
113265 | cp2k.ssmp - ai_contraction.F:141-141 | contraction_ab | Innermost | 0.01 | 0.1 | 0.1 | 1 | 0.46 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
95372 | cp2k.ssmp - grid_ref_prepare_pab.c:57-63 [...] | grid_ref_prepare_pab | InBetween | 0.01 | 0.13 | 0.13 | 1 | 2.40 | 0 | 12.5 | 1 | 1.57 | 12.52 | 1 | NA | NA | NA | NA | NA |
113311 | cp2k.ssmp - ai_contraction.F:353-353 | decontraction_ab | Innermost | 0.01 | 0.09 | 0.09 | 1 | 0.44 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
114297 | cp2k.ssmp - ai_oneelectron.F:567-570 | os_3center | Innermost | 0.01 | 0.09 | 0.09 | 1 | 0.54 | 0 | 25 | 1 | 1.5 | 4 | 1 | 0 | 4 | 0 | 0 | 0 |
114918 | cp2k.ssmp - ai_kinetic.F:177-211 [...] | kinetic | Innermost | 0.01 | 0.07 | 0.07 | 1 | 0.45 | 6.33 | 26.02 | 1 | 2.07 | 4 | 1 | 1 | 0 | 2 | 9 | 0 |
132276 | cp2k.ssmp - dbcsr_transformations.F:1141-1173 | dbcsr_make_dense_low | Single | 0.01 | 0.1 | 0.1 | 1 | 0.00 | 0 | 13.19 | 1 | 1 | 26.54 | 1 | 5 | 0 | 0 | 14.25 | 0 |
113364 | cp2k.ssmp - ai_contraction.F:438-438 | block_add_ab | Innermost | 0.01 | 0.09 | 0.09 | 1 | 0.69 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
114138 | cp2k.ssmp - ai_overlap.F:777-922 | overlap_ab | InBetween | 0.01 | 0.07 | 0.07 | 1 | 0.43 | 4 | 22 | 2.67 | 2.23 | 9.01 | 1 | NA | NA | NA | NA | NA |
109815 | cp2k.ssmp - xc.F:1219-1219 | xc_vxc_pw_create | InBetween | 0.01 | 0.08 | 0.08 | 1 | 0.58 | 0 | 24.55 | 1 | 1 | 7.49 | 1 | NA | NA | NA | NA | NA |
62409 | cp2k.ssmp - core_ppl.F:516-516 | build_core_ppl | InBetween | 0.01 | 0.1 | 0.1 | 1 | 0.59 | 0 | 23.75 | 1 | 1 | 5.74 | 1 | NA | NA | NA | NA | NA |
123942 | cp2k.ssmp - cp_array_sort.F:43-44 | cp_1d_r_sort_low | Single | 0.01 | 0.17 | 0.17 | 1 | 0.02 | 0 | 21.43 | 1.38 | 1 | 5.25 | 1 | 0 | 3 | 0 | 2 | 0 |
95360 | cp2k.ssmp - grid_ref_task_list.c:195-329 [...] | grid_ref_collocate_task_list | InBetween | 0.01 | 0.07 | 0.07 | 1 | 2.84 | 0 | 21.43 | 1 | 1.03 | 6.86 | 1 | NA | NA | NA | NA | NA |
114416 | cp2k.ssmp - ai_oneelectron.F:178-583 [...] | os_3center | Outermost | 0.01 | 0.07 | 0.07 | 1 | 1.05 | 0 | 21.67 | 1 | 1.43 | 7.5 | 1 | 1 | 0 | 4 | 2 | 0 |
95371 | cp2k.ssmp - grid_ref_prepare_pab.c:55-63 [...] | grid_ref_prepare_pab | InBetween | 0.01 | 0.14 | 0.14 | 1 | 2.04 | 0 | 12.5 | 1 | 1.2 | 9.6 | 1 | NA | NA | NA | NA | NA |
164667 | cp2k.ssmp - | mkl_blas_def_dgemm_pst | InBetween | 0.01 | 0.19 | 0.19 | 1 | 2.01 | 17.39 | 28.8 | 2.52 | 2.25 | 6.2 | 1 | NA | NA | NA | NA | NA |
62453 | cp2k.ssmp - core_ppl.F:364-364 | build_core_ppl | Innermost | 0.01 | 0.17 | 0.17 | 1 | 0.73 | 0 | 25 | 1 | 1 | 4 | 1 | 0 | 2 | 0 | 0 | 0 |
95302 | cp2k.ssmp - grid_ref_integrate.c:65-121 [...] | grid_ref_integrate_pgf_product | InBetween | 0.01 | 0.13 | 0.13 | 1 | 1.45 | 0 | 15.28 | 1 | 1.33 | 9.65 | 1 | NA | NA | NA | NA | NA |
62377 | cp2k.ssmp - core_ppl.F:185-586 [...] | build_core_ppl | InBetween | 0.01 | 0.1 | 0.1 | 1 | 1.48 | 30.84 | 44.59 | 3.73 | 2.39 | 1.41 | 1 | NA | NA | NA | NA | NA |
114404 | cp2k.ssmp - ai_oneelectron.F:258-277 | os_3center | Innermost | 0.01 | 0.13 | 0.13 | 1 | 0.57 | 0 | 25 | 1.68 | 1.5 | 4 | 1 | 1 | 0 | 1 | 17 | 0 |
171228 | cp2k.ssmp - | mkl_dft_def_gather_z_z | Innermost | 0.01 | 0.09 | 0.09 | 1 | 2.63 | 0 | 25 | 1 | 1.26 | 5.05 | 1 | 0 | 1 | 0 | 2 | 0 |
114924 | cp2k.ssmp - ai_kinetic.F:147-183 [...] | kinetic | InBetween | 0.01 | 0.14 | 0.14 | 1 | 0.22 | 6.52 | 25 | 7.46 | 2.57 | 6.66 | 1 | NA | NA | NA | NA | NA |
136970 | cp2k.ssmp - dbcsr_block_operations.F:1559-1560 | block_partial_copy_1d2d_d | Outermost | 0.01 | 0.16 | 0.17 | 1 | 0.00 | 0 | 18.33 | 1 | 1 | 7.45 | 1 | NA | NA | NA | NA | NA |
98432 | cp2k.ssmp - dbcsr_vector.F:1123-1123 | dbcsr_sym_matrix_vector_mult_d | InBetween | 0.01 | 0.15 | 0.15 | 1 | 0.69 | 0 | 23.93 | 1 | 1 | 4.47 | 1 | NA | NA | NA | NA | NA |
62452 | cp2k.ssmp - core_ppl.F:364-364 | build_core_ppl | InBetween | 0.01 | 0.08 | 0.08 | 1 | 1.55 | 0 | 25 | 2.29 | 1 | 4 | 1 | NA | NA | NA | NA | NA |
18106 | cp2k.ssmp - qs_overlap.F:476-484 | build_overlap_matrix_low | Innermost | 0.01 | 0.13 | 0.13 | 1 | 0.33 | 0 | 23.13 | 15.2 | 1.12 | 6.51 | 1 | NA | NA | NA | NA | NA |
114327 | cp2k.ssmp - ai_oneelectron.F:514-530 | os_3center | InBetween | 0.01 | 0.17 | 0.17 | 1 | 1.01 | 2 | 23.25 | 19.2 | 1.44 | 6.94 | 1 | NA | NA | NA | NA | NA |
114393 | cp2k.ssmp - ai_oneelectron.F:248-255 | os_3center | Innermost | 0.01 | 0.12 | 0.12 | 1 | 0.65 | 35.94 | 33.98 | 1.06 | 1.06 | 3.4 | 1 | 1 | 0 | 0 | 11 | 0 |
114335 | cp2k.ssmp - ai_oneelectron.F:490-493 | os_3center | Innermost | 0.01 | 0.14 | 0.15 | 1 | 0.15 | 0 | 25 | 1 | 1.5 | 4 | 1 | 0 | 4 | 0 | 0 | 0 |
113357 | cp2k.ssmp - ai_contraction.F:440-440 | block_add_ab | Innermost | 0.01 | 0.11 | 0.11 | 1 | 0.90 | 100 | 100 | 1 | 1 | 1 | 1 | 0 | 2 | 0 | 0 | 0 |
115494 | cp2k.ssmp - ao_util.F:144-147 | exp_radius_very_extended | Innermost | 0.01 | 0.09 | 0.08 | 1 | 0.91 | 19.05 | 27.98 | 1.3 | 1.23 | 4.44 | 1 | 2 | 0 | 0 | 0 | 0 |