| 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 | Speedup If Data in L1 run_0 |
|---|
| 3162 | exec - orbitals.f90:807-1190 [...] | orbitalse | Innermost | 2.97 | 4.07 | 3.67 | 52 | 383.50 | 100 | 50 | 1 | 1.45 | 2 | 1.11 | 0 | 5 | 0 | 0 | 0 | NA |
| 2654 | exec - multideterminant.f90:352-357 | compute_ymat | Innermost | 2.72 | 3.6 | 3.36 | 52 | 100.18 | 0 | 12.5 | 1.21 | 1.66 | 8 | 1.07 | 0 | 1 | 1 | 5 | 0 | NA |
| 2653 | exec - multideterminant.f90:353-357 | compute_ymat | Innermost | 2.31 | 3.18 | 2.86 | 52 | 52.83 | 0 | 12.5 | 1.52 | 1.85 | 8 | 1.11 | 0 | 0 | 2 | 6 | 0 | NA |
| 3085 | exec - orbitals.f90:94-578 [...] | orbitals | Innermost | 2.07 | 2.76 | 2.56 | 52 | 793.08 | 100 | 50 | 1 | 1.33 | 2 | 1.08 | 0 | 6 | 0 | 0 | 0 | NA |
| 3293 | exec - basis_fns.f90:109-130 [...] | basis_fns | Innermost | 2.02 | 2.68 | 2.49 | 52 | 14.32 | 7.69 | 12.98 | 7 | 1 | 15.2 | 1.08 | 1 | 0 | 0 | 10 | 0 | NA |
| 2563 | exec - multideterminante.f90:113-134 | multideterminante | Innermost | 1.66 | 2.32 | 2.05 | 52 | 25.62 | 73.5 | 20.51 | 1.01 | 1.19 | 5.27 | 1.13 | 2 | 1 | 4 | 1 | 1 | NA |
| 2399 | exec - nonloc.f90:795-796 | orbitals_quad | Innermost | 1.59 | 2.16 | 1.97 | 52 | 614.02 | 100 | 50 | 1.37 | 1.44 | 2 | 1.1 | 0 | 2 | 1 | 0 | 0 | NA |
| 2649 | exec - multideterminant.f90:406-420 | compute_ymat | Single | 1.58 | 2.17 | 1.96 | 52 | 31.40 | 0 | 12.5 | 1.65 | 1.95 | 8 | 1.11 | 1 | 5 | 0 | 4 | 1 | NA |
| 4303 | exec - optjas.f90:116-122 | optjas_deloc | InBetween | 1.57 | 2.16 | 1.94 | 52 | 5.83 | 0 | 11.86 | 3.68 | 2 | 11.2 | 1.11 | NA | NA | NA | NA | NA | NA |
| 4552 | exec - optorb.f90:991-995 | optorb_define | Innermost | 1.34 | 1.75 | 1.66 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.05 | 0 | 1 | 0 | 0 | 0 | NA |
| 2549 | exec - multideterminante.f90:166-169 | multideterminante | Innermost | 1.31 | 1.88 | 1.62 | 52 | 36.54 | 0 | 12.5 | 1 | 1.78 | 8 | 1.16 | 0 | 2 | 0 | 4 | 1 | NA |
| 2589 | exec - multideterminante.f90:259-260 | multideterminante_grad | Innermost | 1.06 | 1.49 | 1.31 | 52 | 53.61 | 0 | 12.5 | 1 | 1.89 | 8 | 1.14 | 0 | 1 | 0 | 3 | 0 | NA |
| 4579 | exec - get_norbterm.f90:182-186 | get_norbterm | Innermost | 1.02 | 1.35 | 1.26 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.07 | 0 | 1 | 0 | 0 | 0 | NA |
| 2650 | exec - multideterminant.f90:376-380 | compute_ymat | Single | 0.9 | 1.35 | 1.11 | 52 | 8.47 | 0 | 12.5 | 1.16 | 1.68 | 8 | 1.22 | 1 | 3 | 0 | 3 | 0 | NA |
| 4434 | exec - optorb.f90:39-87 [...] | optorb_deriv | InBetween | 0.87 | 1.18 | 1.08 | 52 | 55.47 | 0 | 11.73 | 3.54 | 3.01 | 13.49 | 1.09 | NA | NA | NA | NA | NA | NA |
| 4302 | exec - optjas.f90:44-123 [...] | optjas_deloc | InBetween | 0.82 | 1.13 | 1.01 | 52 | 21.43 | 0 | 11.75 | 3.1 | 1 | 9.77 | 1.12 | NA | NA | NA | NA | NA | NA |
| 4436 | exec - optorb.f90:69-73 | optorb_deriv | Innermost | 0.79 | 1.07 | 0.97 | 52 | 63.80 | 0 | 12.5 | 1 | 2.31 | 8 | 1.1 | 1 | 0 | 2 | 10 | 1 | NA |
| 4301 | exec - optjas.f90:128-131 | optjas_deloc | Innermost | 0.7 | 1.06 | 0.86 | 52 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.23 | 0 | 2 | 0 | 1 | 1 | NA |
| 4330 | exec - optjas.f90:88-90 | optjas_deloc | Innermost | 0.66 | 0.92 | 0.81 | 52 | 190.83 | 10 | 13.75 | 1.05 | 1.36 | 8 | 1.14 | 1 | 6 | 0 | 2 | 0 | NA |
| 2565 | exec - multideterminante.f90:72-77 | multideterminante | Innermost | 0.66 | 0.93 | 0.82 | 52 | 4.63 | 52.63 | 28.29 | 1.68 | 1.47 | 2.94 | 1.15 | 1 | 0 | 0 | 10 | 0 | NA |
| 2554 | exec - multideterminante.f90:164-164 | multideterminante | Innermost | 0.65 | 0.94 | 0.8 | 52 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1.17 | 0 | 1 | 0 | 0 | 0 | NA |
| 4329 | exec - optjas.f90:88-90 | optjas_deloc | Innermost | 0.55 | 0.82 | 0.68 | 52 | 76.53 | 72.55 | 21.57 | 1 | 1.14 | 4.73 | 1.21 | 2 | 3 | 0 | 0 | 2 | NA |
| 4575 | exec - get_norbterm.f90:59-194 [...] | get_norbterm | InBetween | 0.54 | 0.81 | 0.66 | 52 | 0.00 | 0 | 10 | 1 | 1 | 13.82 | 1.23 | NA | NA | NA | NA | NA | NA |
| 4307 | exec - optjas.f90:103-109 | optjas_deloc | Innermost | 0.48 | 0.72 | 0.59 | 52 | 4.88 | 0 | 12.5 | 2.35 | 1.82 | 8 | 1.22 | 1 | 1 | 1 | 10 | 0 | NA |
| 2600 | exec - multideterminante.f90:243-244 | multideterminante_grad | Innermost | 0.48 | 0.75 | 0.6 | 52 | 77.33 | 80 | 22.5 | 1.29 | 1.48 | 5.94 | 1.25 | 0 | 4 | 1 | 0 | 0 | NA |
| 7926 | exec - | __powidf2 | Innermost | 0.47 | 0.7 | 0.58 | 52 | 23.79 | 0 | 12.5 | 1 | 8 | 8 | 1.21 | 0 | 0 | 0 | 0 | 0 | NA |
| 4297 | exec - optjas.f90:154-157 | optjas_deloc | Innermost | 0.45 | 0.71 | 0.55 | 52 | 233.24 | 100 | 50 | 1 | 1.5 | 2 | 1.29 | 0 | 5 | 0 | 0 | 0 | NA |
| 4272 | exec - detsav.f90:70-71 | detsav | Innermost | 0.4 | 0.6 | 0.49 | 52 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.22 | 0 | 8 | 0 | 0 | 0 | NA |
| 3196 | exec - determinante_psit.f90:29-30 | determinante_psit | Single | 0.36 | 0.58 | 0.44 | 52 | 228.36 | 100 | 50 | 1 | 1.5 | 2 | 1.32 | 0 | 3 | 0 | 0 | 0 | NA |
| 4549 | exec - optorb.f90:880-1005 [...] | optorb_define | InBetween | 0.36 | 0.54 | 0.44 | 52 | 0.00 | 0 | 9.66 | 1 | 1 | 13.78 | 1.23 | NA | NA | NA | NA | NA | NA |
| 3294 | exec - basis_fns.f90:102-103 | basis_fns | Innermost | 0.35 | 0.55 | 0.43 | 52 | 8.49 | 16.67 | 13.54 | 1 | 1 | 14.43 | 1.28 | 0 | 0 | 0 | 1 | 0 | NA |
| 2621 | exec - multideterminant.f90:107-113 | multideterminant_hpsi | Innermost | 0.35 | 0.55 | 0.44 | 52 | 173.07 | 8.45 | 13.56 | 1.06 | 1.06 | 8 | 1.25 | 1 | 5 | 1 | 3 | 0 | NA |
| 3194 | exec - determinante_psit.f90:25-26 | determinante_psit | Single | 0.35 | 0.55 | 0.44 | 52 | 227.36 | 100 | 50 | 1 | 1.5 | 2 | 1.28 | 0 | 3 | 0 | 0 | 0 | NA |
| 2596 | exec - multideterminante.f90:220-249 [...] | multideterminante_grad | InBetween | 0.32 | 0.48 | 0.39 | 52 | 140.90 | 33.82 | 16.64 | 1.93 | 1.77 | 8.86 | 1.23 | NA | NA | NA | NA | NA | NA |
| 2611 | exec - multideterminant.f90:188-236 [...] | multideterminant_hpsi | Innermost | 0.3 | 0.47 | 0.37 | 52 | 27.68 | 73.45 | 20.9 | 1 | 1.14 | 5.03 | 1.27 | 2 | 2 | 3 | 2 | 1 | NA |
| 4277 | exec - detsav.f90:53-54 | detsav | Innermost | 0.26 | 0.43 | 0.33 | 52 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.34 | 0 | 0 | 0 | 6 | 0 | NA |
| 3083 | exec - orbitals.f90:94-579 [...] | orbitals | InBetween | 0.25 | 0.39 | 0.31 | 52 | 592.32 | 24.46 | 15.42 | 1.76 | 2.01 | 9.04 | 1.26 | 1 | 1 | 1 | 5.75 | 0 | NA |
| 7925 | exec - | __powidf2 | Outermost | 0.25 | 0.38 | 0.31 | 52 | 22.29 | 0 | 6.25 | 1 | 1 | 16 | 1.23 | 0 | 0 | 0 | 0 | 0 | NA |
| 2598 | exec - multideterminante.f90:247-248 | multideterminante_grad | Innermost | 0.22 | 0.35 | 0.28 | 52 | 71.46 | 100 | 50 | 1 | 1 | 2 | 1.25 | 0 | 2 | 1 | 0 | 0 | NA |
| 2597 | exec - multideterminante.f90:247-248 | multideterminante_grad | Innermost | 0.21 | 0.32 | 0.26 | 52 | 113.81 | 0 | 12.5 | 1 | 1 | 8 | 1.23 | 0 | 9 | 0 | 0 | 0 | NA |
| 7830 | exec - | __intel_avx_rep_memcpy | Single | 0.2 | 0.32 | 0.25 | 52 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1.28 | 0 | 2 | 0 | 0 | 0 | NA |
| 2630 | exec - multideterminant.f90:272-278 | multideterminant_hpsi | Innermost | 0.2 | 0.33 | 0.25 | 52 | 47.88 | 0 | 12.5 | 1.13 | 1.59 | 8 | 1.32 | 0 | 0 | 0 | 8 | 2 | NA |
| 2632 | exec - multideterminant.f90:272-278 | multideterminant_hpsi | Innermost | 0.18 | 0.28 | 0.23 | 52 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.22 | 0 | 2 | 0 | 1 | 1 | NA |
| 2579 | exec - multideterminante.f90:61-63 | multideterminante | Innermost | 0.17 | 0.28 | 0.21 | 52 | 238.48 | 100 | 50 | 1 | 1 | 2 | 1.33 | 1 | 4 | 4 | 0 | 0 | NA |
| 3160 | exec - orbitals.f90:807-1191 [...] | orbitalse | Outermost | 0.17 | 0.28 | 0.21 | 52 | 529.00 | 29.11 | 15.96 | 1.49 | 2.16 | 9.16 | 1.33 | 1 | 0 | 0 | 8 | 0 | NA |
| 2588 | exec - multideterminante.f90:220-263 [...] | multideterminante_grad | Outermost | 0.16 | 0.25 | 0.19 | 52 | 52.32 | 0 | 12.5 | 1 | 1 | 8 | 1.32 | NA | NA | NA | NA | NA | NA |
| 2651 | exec - multideterminant.f90:344-357 [...] | compute_ymat | Outermost | 0.16 | 0.26 | 0.2 | 52 | 69.75 | 0 | 12.22 | 6.42 | 2.46 | 11.95 | 1.3 | NA | NA | NA | NA | NA | NA |
| 2578 | exec - multideterminante.f90:37-63 [...] | multideterminante | InBetween | 0.16 | 0.27 | 0.19 | 52 | 181.42 | 42.22 | 18.16 | 1.73 | 1 | 5.62 | 1.42 | 1 | 0 | 0 | 14.67 | 0 | NA |
| 4236 | exec - jastrow4e.f90:55-296 [...] | jastrow4e | Outermost | 0.16 | 0.28 | 0.19 | 52 | 31.84 | 12.78 | 13.65 | 2.47 | 2.41 | 10.38 | 1.47 | NA | NA | NA | NA | NA | NA |
| 2613 | exec - multideterminant.f90:157-163 | multideterminant_hpsi | Innermost | 0.15 | 0.25 | 0.19 | 52 | 4.00 | 67.35 | 19.9 | 1.45 | 1.55 | 5 | 1.32 | 1 | 0 | 0 | 6 | 0 | NA |
| 4433 | exec - optorb.f90:39-94 [...] | optorb_deriv | Outermost | 0.15 | 0.26 | 0.18 | 52 | 63.89 | 9.76 | 13.72 | 4.4 | 1 | 8 | 1.44 | NA | NA | NA | NA | NA | NA |
| 3295 | exec - basis_fns.f90:93-98 | basis_fns | Innermost | 0.15 | 0.26 | 0.18 | 52 | 58.61 | 16.07 | 14.84 | 2.23 | 1 | 12.02 | 1.44 | 1 | 0 | 0 | 2.5 | 0 | NA |
| 4270 | exec - detsav.f90:46-80 [...] | detsav | InBetween | 0.13 | 0.22 | 0.17 | 52 | 0.00 | 0 | 11.25 | 1 | 1 | 12.36 | 1.29 | NA | NA | NA | NA | NA | NA |
| 2640 | exec - multideterminant.f90:269-269 | multideterminant_hpsi | Innermost | 0.13 | 0.21 | 0.16 | 52 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1.31 | 0 | 1 | 0 | 0 | 0 | NA |
| 2568 | exec - multideterminante.f90:61-63 | multideterminante | Innermost | 0.13 | 0.24 | 0.16 | 52 | 302.88 | 48.08 | 18.51 | 1 | 1.96 | 7.33 | 1.5 | 1 | 8 | 0 | 0 | 0 | NA |
| 2688 | exec - multideterminant.f90:625-629 | compute_zmat | Innermost | 0.12 | 0.21 | 0.15 | 52 | 81.33 | 0 | 12.5 | 1 | 2.3 | 8 | 1.4 | 1 | 1 | 3 | 8 | 0 | NA |
| 3334 | exec - determinant.f90:276-279 | compute_bmatrices_kin | Innermost | 0.12 | 0.23 | 0.15 | 52 | 180.60 | 100 | 50 | 1 | 1.47 | 2 | 1.53 | 0 | 4 | 0 | 0 | 0 | NA |
| 2625 | exec - multideterminant.f90:100-159 [...] | multideterminant_hpsi | InBetween | 0.12 | 0.22 | 0.15 | 52 | 32.87 | 56.08 | 26.38 | 1.18 | 1 | 3 | 1.47 | 1.67 | 0 | 0 | 32.33 | 0 | NA |
| 2396 | exec - nonloc.f90:795-796 | orbitals_quad | Innermost | 0.11 | 0.21 | 0.13 | 52 | 273.92 | 100 | 50 | 1 | 1.54 | 2 | 1.62 | 0 | 2 | 0 | 0 | 0 | NA |
| 2687 | exec - multideterminant.f90:623-630 | compute_zmat | InBetween | 0.11 | 0.19 | 0.14 | 52 | 117.36 | 8 | 13.5 | 3.27 | 2.01 | 8 | 1.36 | NA | NA | NA | NA | NA | NA |
| 4578 | exec - get_norbterm.f90:182-186 | get_norbterm | Innermost | 0.11 | 0.21 | 0.14 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.5 | 0 | 1 | 0 | 0 | 0 | NA |
| 4328 | exec - optjas.f90:44-93 [...] | optjas_deloc | InBetween | 0.11 | 0.2 | 0.14 | 52 | 103.43 | 26.57 | 15.64 | 2.37 | 2.86 | 10.27 | 1.43 | 1.67 | 0 | 0 | 7.67 | 0 | NA |
| 4622 | exec - optci.f90:56-58 | optci_deloc | Innermost | 0.11 | 0.19 | 0.14 | 52 | 58.57 | 100 | 50 | 1 | 1.42 | 2 | 1.36 | 0 | 6 | 0 | 0 | 0 | NA |
| 3292 | exec - basis_fns.f90:71-131 [...] | basis_fns | InBetween | 0.1 | 0.18 | 0.12 | 52 | 8.00 | 0 | 11.34 | 2.33 | 1.4 | 7 | 1.5 | NA | NA | NA | NA | NA | NA |
| 4577 | exec - get_norbterm.f90:190-191 | get_norbterm | Innermost | 0.1 | 0.17 | 0.12 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.42 | 0 | 1 | 0 | 0 | 0 | NA |
| 2692 | exec - multideterminant.f90:704-706 | idiff | Single | 0.1 | 0.18 | 0.12 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.5 | 0 | 4 | 0 | 0 | 0 | NA |
| 6066 | exec - metrop_mov1_slat.f90:145-785 [...] | metrop6 | Outermost | 0.1 | 0.2 | 0.12 | 52 | 14.50 | 16.18 | 13.56 | 2.27 | 2.15 | 5.44 | 1.67 | NA | NA | NA | NA | NA | NA |
| 4621 | exec - optci.f90:65-68 | optci_deloc | Innermost | 0.09 | 0.18 | 0.12 | 52 | 33.00 | 100 | 50 | 1 | 1 | 2 | 1.5 | 0 | 5 | 0 | 0 | 0 | NA |
| 2397 | exec - nonloc.f90:460-797 [...] | orbitals_quad | InBetween | 0.09 | 0.16 | 0.11 | 52 | 488.82 | 27.87 | 15.89 | 1.79 | 1.21 | 7.36 | 1.45 | 1 | 0 | 0 | 7 | 0 | NA |
| 2083 | exec - set_input_data.f90:233-234 | multideterminants_define | Innermost | 0.09 | 0.17 | 0.11 | 52 | 0.00 | 0 | 9.38 | 1 | 1 | 16 | 1.55 | 1 | 0 | 0 | 0 | 0 | NA |
| 4551 | exec - optorb.f90:999-1000 | optorb_define | Innermost | 0.09 | 0.16 | 0.11 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.45 | 0 | 1 | 0 | 0 | 0 | NA |
| 7831 | exec - | __intel_avx_rep_memset | Single | 0.08 | 0.16 | 0.1 | 52 | 0.30 | 100 | 50 | 1 | 1 | 2 | 1.6 | 0 | 1 | 0 | 0 | 0 | NA |
| 2315 | exec - deriv_nonloc.f90:324-449 [...] | deriv_nonlocj_quad4 | InBetween | 0.08 | 0.16 | 0.1 | 52 | 15.00 | 10.53 | 11.51 | 3.25 | 1.96 | 12.73 | 1.6 | NA | NA | NA | NA | NA | NA |
| 4331 | exec - optjas.f90:88-93 | optjas_deloc | InBetween | 0.08 | 0.16 | 0.1 | 52 | 213.90 | 27.27 | 15.34 | 1.87 | 1.27 | 11.47 | 1.6 | 1 | 0 | 0 | 12 | 0 | NA |
| 4461 | exec - optorb.f90:171-174 | optorb_sum | Innermost | 0.08 | 0.15 | 0.1 | 52 | 57.60 | 100 | 50 | 1 | 1.17 | 2 | 1.5 | 0 | 6 | 0 | 0 | 0 | NA |
| 2418 | exec - nonloc.f90:1192-1195 | nonlocj_quad4 | Innermost | 0.07 | 0.12 | 0.08 | 52 | 10.88 | 0 | 11.98 | 2.88 | 1.84 | 11.15 | 1.5 | 1 | 0 | 0 | 2 | 0 | NA |
| 4435 | exec - optorb.f90:81-84 | optorb_deriv | Innermost | 0.07 | 0.12 | 0.08 | 52 | 41.88 | 0 | 12.5 | 1.37 | 1.56 | 8 | 1.5 | 1 | 2 | 0 | 10 | 0 | NA |
| 2550 | exec - multideterminante.f90:169-169 | multideterminante | Innermost | 0.06 | 0.12 | 0.07 | 52 | 0.00 | NA | NA | 1 | NA | NA | 1.71 | 0 | 0 | 0 | 0 | 0 | NA |
| 2623 | exec - multideterminant.f90:107-113 | multideterminant_hpsi | Innermost | 0.06 | 0.13 | 0.07 | 52 | 293.57 | 0 | 12.5 | 1 | 1.11 | 8 | 1.86 | 0 | 4 | 0 | 3 | 0 | NA |
| 2585 | exec - multideterminante.f90:52-54 | multideterminante | Innermost | 0.06 | 0.11 | 0.07 | 52 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.57 | 0 | 2 | 0 | 4 | 0 | NA |
| 3286 | exec - basis_fns.f90:62-228 [...] | basis_fns | Outermost | 0.06 | 0.11 | 0.07 | 52 | 0.71 | 8.65 | 12.32 | 6.02 | 1 | 9.49 | 1.57 | NA | NA | NA | NA | NA | NA |
| 1208 | exec - optwf_sr.f90:497-500 | sr_hs | Innermost | 0.06 | 0.09 | 0.07 | 52 | 162.00 | 0 | 12.5 | 1.14 | 1.33 | 8 | 1.29 | 0 | 4 | 0 | 0 | 0 | NA |
| 2672 | exec - multideterminant.f90:497-532 | compute_dymat | Single | 0.06 | 0.14 | 0.07 | 52 | 181.71 | 0 | 12.5 | 1.52 | 2.52 | 8 | 2 | 1 | 4 | 1 | 2 | 2 | NA |
| 2546 | exec - multideterminante.f90:180-181 | multideterminante | Innermost | 0.06 | 0.13 | 0.07 | 52 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.86 | 0 | 1 | 0 | 3 | 0 | NA |
| 3084 | exec - orbitals.f90:94-578 [...] | orbitals | Innermost | 0.05 | 0.09 | 0.06 | 52 | 373.00 | 0 | 12.5 | 1 | 1.33 | 8 | 1.5 | 0 | 6 | 0 | 0 | 0 | NA |
| 2417 | exec - nonloc.f90:1092-1199 [...] | nonlocj_quad4 | InBetween | 0.05 | 0.12 | 0.06 | 52 | 19.33 | 9.09 | 12.03 | 3.35 | 2.17 | 7.7 | 2 | NA | NA | NA | NA | NA | NA |
| 2545 | exec - multideterminante.f90:37-184 [...] | multideterminante | Outermost | 0.05 | 0.1 | 0.06 | 52 | 3.00 | 9.28 | 13.05 | 4.26 | 1 | 13.16 | 1.67 | NA | NA | NA | NA | NA | NA |
| 2599 | exec - multideterminante.f90:243-244 | multideterminante_grad | Innermost | 0.05 | 0.12 | 0.06 | 52 | 312.33 | 0 | 12.5 | 1 | 1.1 | 8 | 2 | 0 | 9 | 0 | 0 | 1 | NA |
| 2575 | exec - multideterminante.f90:61-63 | multideterminante | Innermost | 0.05 | 0.1 | 0.07 | 52 | 81.57 | 0 | 12.5 | 1 | 1 | 8 | 1.43 | 0 | 5 | 0 | 0 | 0 | NA |
| 2343 | exec - nonloc.f90:273-275 | nonloc | Innermost | 0.05 | 0.1 | 0.06 | 52 | 393.33 | 100 | 50 | 1.09 | 1.09 | 2 | 1.67 | 0 | 2 | 2 | 0 | 0 | NA |
| 2673 | exec - multideterminant.f90:479-485 | compute_dymat | Single | 0.05 | 0.09 | 0.06 | 52 | 16.00 | 0 | 12.5 | 2.07 | 2.42 | 8 | 1.5 | 1 | 0 | 1 | 5 | 0 | NA |
| 2576 | exec - multideterminante.f90:37-63 [...] | multideterminante | InBetween | 0.05 | 0.11 | 0.07 | 52 | 451.29 | 0 | 12.2 | 3.02 | 1 | 10.03 | 1.57 | 1 | 0 | 0 | 7.67 | 0 | NA |
| 3086 | exec - orbitals.f90:562-579 [...] | orbitals | Innermost | 0.04 | 0.09 | 0.05 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.8 | 0 | 1 | 1 | 1 | 0 | NA |
| 2574 | exec - multideterminante.f90:37-64 [...] | multideterminante | InBetween | 0.04 | 0.1 | 0.04 | 52 | 286.75 | 0 | 12.34 | 1 | 1 | 11 | 2.5 | NA | NA | NA | NA | NA | NA |
| 3161 | exec - orbitals.f90:807-1190 [...] | orbitalse | Innermost | 0.04 | 0.12 | 0.05 | 52 | 674.20 | 0 | 12.5 | 1 | 1.6 | 8 | 2.4 | 0 | 5 | 0 | 0 | 0 | NA |
| 2265 | exec - jassav.f90:33-39 | jassav | Innermost | 0.04 | 0.08 | 0.04 | 52 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 2 | 0 | 0 | 0 | 4 | 0 | NA |
| 2340 | exec - nonloc.f90:273-275 | nonloc | Innermost | 0.04 | 0.08 | 0.05 | 52 | 249.60 | 100 | 50 | 1 | 1.41 | 2 | 1.6 | 0 | 2 | 0 | 0 | 0 | NA |
| 1207 | exec - optwf_sr.f90:502-507 | sr_hs | Innermost | 0.04 | 0.07 | 0.04 | 52 | 168.75 | 0 | 12.5 | 1.14 | 1.33 | 8 | 1.75 | 0 | 4 | 0 | 0 | 0 | NA |
| 2319 | exec - deriv_nonloc.f90:398-403 | deriv_nonlocj_quad4 | Innermost | 0.04 | 0.09 | 0.06 | 52 | 12.67 | 0 | 10.44 | 1.96 | 1.98 | 13.35 | 1.5 | 1 | 1 | 0 | 4 | 0 | NA |
| 2684 | exec - multideterminant.f90:638-641 | compute_zmat | Innermost | 0.04 | 0.09 | 0.05 | 52 | 297.60 | 100 | 50 | 1.25 | 1.43 | 2 | 1.8 | 1 | 4 | 2 | 0 | 0 | NA |
| 3299 | exec - determinant_psit.f90:20-21 | determinant_psit | Single | 0.04 | 0.09 | 0.06 | 52 | 168.67 | 100 | 50 | 1 | 1.5 | 2 | 1.5 | 0 | 3 | 0 | 0 | 0 | NA |
| 2679 | exec - multideterminant.f90:638-641 | compute_zmat | Innermost | 0.04 | 0.09 | 0.05 | 52 | 219.20 | 0 | 12.5 | 1.31 | 1.44 | 8 | 1.8 | 1 | 9 | 2 | 0 | 0 | NA |
| 2582 | exec - multideterminante.f90:63-64 | multideterminante | Innermost | 0.04 | 0.09 | 0.06 | 52 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1.5 | 0 | 1 | 0 | 0 | 0 | NA |
| 2587 | exec - multideterminante.f90:220-263 [...] | multideterminante_grad | InBetween | 0.04 | 0.09 | 0.05 | 52 | 2.00 | 12.5 | 14.06 | 10 | 1 | 8 | 1.8 | NA | NA | NA | NA | NA | NA |
| 2577 | exec - multideterminante.f90:61-63 | multideterminante | Innermost | 0.04 | 0.09 | 0.05 | 52 | 121.00 | 100 | 50 | 1 | 1 | 2 | 1.8 | 0 | 5 | 0 | 0 | 0 | NA |
| 2471 | exec - deriv_jastrow4.f90:76-488 [...] | deriv_jastrow4 | Outermost | 0.04 | 0.09 | 0.05 | 52 | 52.40 | 7.57 | 12.78 | 2.83 | 1.39 | 9.36 | 1.8 | NA | NA | NA | NA | NA | NA |
| 4326 | exec - optjas.f90:44-94 [...] | optjas_deloc | InBetween | 0.03 | 0.06 | 0.04 | 52 | 286.25 | 26.47 | 15.63 | 2.13 | 1 | 8.26 | 1.5 | NA | NA | NA | NA | NA | NA |
| 4266 | exec - detsav.f90:96-100 | detsav | Innermost | 0.03 | 0.09 | 0.04 | 52 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 2.25 | 0 | 1 | 0 | 3 | 0 | NA |
| 4211 | exec - hpsi.f90:198-200 | hpsi | Innermost | 0.03 | 0.06 | 0.04 | 52 | 40.00 | 27.27 | 20.45 | 2.13 | 1.59 | 6.53 | 1.5 | 1 | 2 | 3 | 1 | 0 | NA |
| 4565 | exec - optorb.f90:932-933 | optorb_define | Innermost | 0.03 | 0.05 | 0.04 | 52 | 0.00 | 29.86 | 16.87 | 1.46 | 1 | 6.94 | 1.25 | NA | NA | NA | NA | NA | NA |
| 2348 | exec - nonloc.f90:258-259 | nonloc | Innermost | 0.03 | 0.07 | 0.04 | 52 | 138.50 | 100 | 50 | 1 | 1.41 | 2 | 1.75 | 0 | 2 | 0 | 0 | 0 | NA |
| 4231 | exec - jastrow4e.f90:55-356 [...] | jastrow4e | Outermost | 0.03 | 0.06 | 0.03 | 52 | 47.33 | 11.57 | 14.1 | 2.54 | 2.49 | 6.29 | 2 | NA | NA | NA | NA | NA | NA |
| 2381 | exec - nonloc.f90:379-386 | distance_quad | Single | 0.03 | 0.07 | 0.04 | 52 | 19.25 | 0 | 12.5 | 1 | 1.5 | 2 | 1.75 | 0 | 0 | 0 | 3 | 0 | NA |
| 2636 | exec - multideterminant.f90:270-270 | multideterminant_hpsi | Innermost | 0.03 | 0.07 | 0.04 | 52 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1.75 | 0 | 1 | 0 | 0 | 0 | NA |
| 2590 | exec - multideterminante.f90:220-251 [...] | multideterminante_grad | Outermost | 0.03 | 0.06 | 0.03 | 52 | 15.67 | 0 | 12.16 | 1 | 1 | 9.17 | 2 | NA | NA | NA | NA | NA | NA |
| 2580 | exec - multideterminante.f90:63-64 | multideterminante | Innermost | 0.02 | 0.06 | 0.03 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 2 | 0 | 1 | 0 | 0 | 0 | NA |
| 2484 | exec - deriv_jastrow4.f90:194-258 | deriv_jastrow4 | Innermost | 0.02 | 0.05 | 0.03 | 52 | 107.67 | 5.19 | 12.69 | 1.26 | 1.51 | 3.38 | 1.67 | NA | NA | NA | NA | NA | NA |
| 378 | exec - m_ewald.f90:223-223 | allocate_periodic | Innermost | 0.02 | 0.05 | 0.03 | 52 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.67 | 0 | 1 | 0 | 0 | 0 | NA |
| 3997 | exec - multiply_slmi_mderiv.f90:18-34 [...] | multiply_slmi_mderiv_simple | InBetween | 0.02 | 0.04 | 0.02 | 52 | 68.50 | 0 | 12.5 | 4.11 | 1 | 8 | 2 | 1 | 0.5 | 0.5 | 5.5 | 1 | NA |
| 3390 | exec - bxmatrices.f90:40-41 | bxmatrix | Innermost | 0.02 | 0.04 | 0.02 | 51 | 0.00 | 66.67 | 16.67 | 1.13 | 1 | 7.2 | 2 | 0 | 2 | 0 | 2 | 0 | NA |
| 2321 | exec - deriv_nonloc.f90:390-391 | deriv_nonlocj_quad4 | Innermost | 0.02 | 0.04 | 0.02 | 52 | 29.50 | 60 | 20 | 2.63 | 2.71 | 7.64 | 2 | 0 | 1 | 2 | 0 | 0 | NA |
| 4187 | exec - jastrow4.f90:55-273 [...] | jastrow_factor4 | InBetween | 0.02 | 0.05 | 0.02 | 52 | 100.50 | 11.41 | 13.17 | 2.48 | 2.55 | 11.57 | 2.5 | NA | NA | NA | NA | NA | NA |
| 7154 | exec - | for_check_mult_overflow64 | Single | 0.02 | 0.05 | 0.03 | 52 | 0.00 | 0 | 10.72 | 1 | 1 | 11.89 | 1.67 | 1 | 0 | 0 | 1 | 0 | NA |
| 4439 | exec - optorb.f90:124-126 | optorb_compute | Innermost | 0.02 | 0.05 | 0.03 | 51 | 68.00 | 100 | 50 | 1 | 1 | 2 | 1.67 | 0 | 3 | 0 | 0 | 0 | NA |
| 4327 | exec - optjas.f90:88-90 | optjas_deloc | Innermost | 0.02 | 0.05 | 0.02 | 52 | 0.00 | 0 | 12.5 | 1 | 1.31 | 8 | 2.5 | 1 | 3 | 0 | 2 | 0 | NA |
| 3188 | exec - readps_gauss.f90:23-49 | getvps_gauss | Outermost | 0.02 | 0.04 | 0.02 | 52 | 74.00 | 20.79 | 14.16 | 3.28 | 1.93 | 11.42 | 2 | 3 | 0 | 0 | 10 | 0 | NA |
| 3190 | exec - readps_gauss.f90:72-87 | gauss_pot | Single | 0.02 | 0.05 | 0.02 | 52 | 50.00 | 30.04 | 15.97 | 1.28 | 2.49 | 8.91 | 2.5 | 2 | 2.5 | 0 | 0 | 0 | NA |
| 3338 | exec - determinant.f90:263-265 | compute_bmatrices_kin | Innermost | 0.02 | 0.05 | 0.03 | 52 | 252.00 | 100 | 50 | 1 | 1.5 | 2 | 1.67 | 0 | 5 | 0 | 0 | 0 | NA |
| 2624 | exec - multideterminant.f90:107-117 | multideterminant_hpsi | InBetween | 0.02 | 0.05 | 0.02 | 52 | 375.50 | 38.46 | 17.31 | 2.33 | 2.33 | 8 | 2.5 | 1 | 0 | 0 | 10 | 0 | NA |
| 4325 | exec - optjas.f90:88-90 | optjas_deloc | Innermost | 0.02 | 0.04 | 0.02 | 52 | 48.00 | 79.59 | 22.45 | 1 | 1.11 | 4.63 | 2 | 1 | 2 | 0 | 0 | 2 | NA |
| 2398 | exec - nonloc.f90:795-796 | orbitals_quad | Innermost | 0.02 | 0.06 | 0.03 | 52 | 840.33 | 0 | 12.5 | 1 | 1.06 | 8 | 2 | 0 | 9 | 0 | 0 | 0 | NA |
| 4592 | exec - get_norbterm.f90:125-126 | get_norbterm | Innermost | 0.02 | 0.03 | 0.02 | 52 | 0.00 | 29.86 | 16.87 | 1.46 | 1 | 6.94 | 1.5 | NA | NA | NA | NA | NA | NA |
| 3985 | exec - distances.f90:275-290 [...] | distancese_restore | Single | 0.02 | 0.05 | 0.02 | 50 | 0.00 | 11.11 | 13.89 | 2.05 | 1 | 7.64 | 2.5 | 0.5 | 0.5 | 0 | 2 | 0 | NA |
| 3982 | exec - distances.f90:51-58 | distances | Single | 0.02 | 0.04 | 0.02 | 52 | 0.00 | 28.57 | 15.18 | 1.92 | 1 | 11.29 | 2 | 1 | 2 | 0 | 3 | 0 | NA |
| 3082 | exec - orbitals.f90:580-580 | orbitals | Innermost | 0.02 | 0.06 | 0.03 | 52 | 6.00 | 0 | 12.5 | 1.88 | 1 | 8 | 2 | 0 | 1 | 1 | 1 | 0 | NA |
| 3409 | exec - deriv_nonlpsi.f90:243-257 | deriv_psibnl | Single | 0.02 | 0.05 | 0.03 | 51 | 27.00 | 11.76 | 13.79 | 1.3 | 1.41 | 10.34 | 1.67 | NA | NA | NA | NA | NA | NA |
| 4000 | exec - multiply_slmi_mderiv.f90:33-34 | multiply_slmi_mderiv_simple | Innermost | 0.02 | 0.05 | 0.02 | 52 | 166.50 | 0 | 12.5 | 1 | 1 | 8 | 2.5 | 0 | 1 | 0 | 1 | 0 | NA |
| 2581 | exec - multideterminante.f90:37-65 [...] | multideterminante | InBetween | 0.02 | 0.05 | 0.03 | 52 | 0.00 | 0 | 10.97 | 1 | 1 | 13.03 | 1.67 | 0 | 0 | 0 | 1 | 0 | NA |
| 2286 | exec - gammai.f90:74-78 | gammai | Single | 0.02 | 0.05 | 0.02 | 52 | 33.50 | 0 | 12.5 | 1 | 8 | 8 | 2.5 | 0 | 0 | 0 | 0 | 0 | NA |
| 377 | exec - m_ewald.f90:223-223 | allocate_periodic | Innermost | 0.02 | 0.04 | 0.02 | 51 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 2 | 0 | 1 | 0 | 0 | 0 | NA |
| 3387 | exec - bxmatrices.f90:40-41 | bxmatrix | Innermost | 0.02 | 0.04 | 0.02 | 52 | 0.00 | 66.67 | 16.67 | 1.13 | 1 | 7.2 | 2 | 0 | 2 | 0 | 2 | 0 | NA |
| 2467 | exec - deriv_jastrow4.f90:76-609 [...] | deriv_jastrow4 | InBetween | 0.02 | 0.05 | 0.02 | 52 | 87.00 | 6 | 12.81 | 2.11 | 2.45 | 8.55 | 2.5 | NA | NA | NA | NA | NA | NA |
| 3999 | exec - multiply_slmi_mderiv.f90:33-34 | multiply_slmi_mderiv_simple | Innermost | 0.02 | 0.05 | 0.02 | 52 | 64.00 | 0 | 12.5 | 1 | 1.54 | 8 | 2.5 | 0 | 1 | 0 | 8 | 0 | NA |
| 3042 | exec - matinv.f90:69-82 | matinv | Outermost | 0.01 | 0.03 | 0.01 | 37 | 4.00 | 22.22 | 14.58 | 1.33 | 2 | 12.69 | 3 | NA | NA | NA | NA | NA | NA |
| 2567 | exec - multideterminante.f90:37-65 [...] | multideterminante | InBetween | 0.01 | 0.03 | 0.01 | 40 | 0.00 | 0 | 12.25 | 1 | 1 | 8 | 3 | NA | NA | NA | NA | NA | NA |
| 2837 | exec - jastrowe.f90:42-51 | jastrowe | Outermost | 0.01 | 0.04 | 0.01 | 45 | 3.00 | 0 | 11.49 | 4.81 | 1 | 14.57 | 4 | NA | NA | NA | NA | NA | NA |
| 2569 | exec - multideterminante.f90:37-64 [...] | multideterminante | InBetween | 0.01 | 0.04 | 0.01 | 50 | 77.00 | 0 | 12.24 | 1 | 1 | 8.19 | 4 | NA | NA | NA | NA | NA | NA |
| 3342 | exec - determinante.f90:38-59 [...] | determinante | InBetween | 0.01 | 0.04 | 0.01 | 49 | 50.00 | 21.74 | 14.4 | 3.44 | 2.95 | 11.67 | 4 | NA | NA | NA | NA | NA | NA |
| 4289 | exec - optjas.f90:44-176 [...] | optjas_deloc | Outermost | 0.01 | 0.03 | 0.01 | 43 | 8.00 | 5.38 | 12.5 | 8.62 | 1 | 11.1 | 3 | NA | NA | NA | NA | NA | NA |
| 7209 | exec - | for_write_seq_fmt_xmit | InBetween | 0.01 | 0.02 | 0.01 | 44 | 0.00 | 0 | 8.74 | 1 | 1 | 2.06 | 2 | NA | NA | NA | NA | NA | NA |
| 3297 | exec - basis_fns.f90:71-71 | basis_fns | Innermost | 0.01 | 0.03 | 0.01 | 41 | 0.00 | 100 | 50 | 1 | 1 | 2 | 3 | 0 | 1 | 0 | 0 | 0 | NA |
| 3296 | exec - basis_fns.f90:71-71 | basis_fns | Innermost | 0.01 | 0.02 | 0.01 | 37 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 2 | 0 | 1 | 0 | 0 | 0 | NA |
| 4299 | exec - optjas.f90:44-137 [...] | optjas_deloc | InBetween | 0.01 | 0.03 | 0.01 | 49 | 3.00 | 0 | 12.13 | 9.39 | 1.86 | 13.17 | 3 | NA | NA | NA | NA | NA | NA |
| 4576 | exec - get_norbterm.f90:190-191 | get_norbterm | Innermost | 0.01 | 0.04 | 0.02 | 49 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 2 | 0 | 1 | 0 | 0 | 0 | NA |
| 4564 | exec - optorb.f90:932-933 | optorb_define | Innermost | 0.01 | 0.03 | 0.01 | 50 | 0.00 | 0 | 10.23 | 1 | 1 | 12.44 | 3 | NA | NA | NA | NA | NA | NA |
| 3984 | exec - distances.f90:30-34 | distances | Single | 0.01 | 0.04 | 0.02 | 51 | 0.00 | 33.33 | 16.67 | 1 | 1 | 6 | 2 | 1 | 1 | 0 | 6 | 0 | NA |
| 3998 | exec - multiply_slmi_mderiv.f90:33-34 | multiply_slmi_mderiv_simple | Innermost | 0.01 | 0.02 | 0.01 | 51 | 78.00 | 0 | 12.5 | 1 | 2.91 | 8 | 2 | 0 | 1 | 0 | 1 | 0 | NA |
| 2366 | exec - nonloc.f90:151-168 | nonloc | Innermost | 0.01 | 0.02 | 0.01 | 49 | 45.00 | 3.85 | 11.78 | 3.42 | 2.44 | 12.65 | 2 | 1 | 0 | 1 | 10 | 0 | NA |
| 4210 | exec - hpsi.f90:198-200 | hpsi | Innermost | 0.01 | 0.02 | 0.01 | 47 | 123.00 | 0 | 12.5 | 1 | 2.67 | 8 | 2 | 0 | 2 | 0 | 1 | 0 | NA |
| 3969 | exec - distances.f90:133-146 | distances | Single | 0.01 | 0.04 | 0.01 | 47 | 34.00 | 0 | 12.5 | 1.25 | 1.88 | 2.5 | 4 | 1 | 1 | 3 | 1 | 0 | NA |
| 2022 | exec - set_input_data.f90:362-371 [...] | multideterminants_define | Innermost | 0.01 | 0.02 | 0.01 | 51 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 2 | 0 | 0 | 0 | 0 | 1 | NA |
| 4183 | exec - jastrow4.f90:55-336 [...] | jastrow_factor4 | InBetween | 0.01 | 0.03 | 0.01 | 52 | 83.00 | 5.95 | 12.65 | 2.64 | 2.19 | 7.09 | 3 | NA | NA | NA | NA | NA | NA |
| 4276 | exec - detsav.f90:51-55 | detsav | InBetween | 0.01 | 0.05 | 0.02 | 52 | 0.00 | 4 | 13 | 1 | 1 | 8 | 2.5 | NA | NA | NA | NA | NA | NA |
| 2572 | exec - multideterminante.f90:37-63 [...] | multideterminante | InBetween | 0.01 | 0.02 | 0.01 | 52 | 136.00 | 0 | 12.5 | 3.5 | 1 | 8 | 2 | 1 | 0 | 0 | 3 | 0 | NA |
| 2646 | exec - multideterminant.f90:432-438 | compute_ymat | InBetween | 0.01 | 0.03 | 0.01 | 41 | 14.00 | 0 | 11.6 | 1 | 1 | 12 | 3 | 1 | 0.5 | 0.5 | 4.5 | 0 | NA |
| 2383 | exec - nonloc.f90:460-846 [...] | orbitals_quad | InBetween | 0.01 | 0.04 | 0.01 | 43 | 40.00 | 5.71 | 12.86 | 5.38 | 1 | 10.42 | 4 | NA | NA | NA | NA | NA | NA |
| 2468 | exec - deriv_jastrow4.f90:552-607 | deriv_jastrow4 | Innermost | 0.01 | 0.03 | 0.01 | 52 | 143.00 | 3.35 | 12.75 | 1.07 | 1.71 | 2.71 | 3 | 2 | 3 | 0 | 3.75 | 0.25 | NA |
| 4298 | exec - optjas.f90:44-147 [...] | optjas_deloc | InBetween | 0.01 | 0.04 | 0.01 | 45 | 1.00 | 6.19 | 13.47 | 5.2 | 1 | 9.77 | 4 | NA | NA | NA | NA | NA | NA |
| 3305 | exec - determinant.f90:67-78 | determinant | Innermost | 0.01 | 0.02 | 0.01 | 44 | 0.00 | 0 | 11.68 | 1 | 1 | 15.1 | 2 | 3 | 0 | 0 | 5 | 0 | NA |
| 3995 | exec - multiply_slmi_mderiv.f90:18-35 [...] | multiply_slmi_mderiv_simple | InBetween | 0.01 | 0.04 | 0.01 | 50 | 131.00 | 0 | 12.33 | 1 | 1 | 8.15 | 4 | NA | NA | NA | NA | NA | NA |
| 6073 | exec - metrop_mov1_slat.f90:349-355 | metrop6 | Innermost | 0.01 | 0.03 | 0.01 | 47 | 28.00 | 40.25 | 17.2 | 1.19 | 2.3 | 7.29 | 3 | 1.5 | 0 | 0 | 2 | 0 | NA |
| 2591 | exec - multideterminante.f90:220-249 [...] | multideterminante_grad | InBetween | 0.01 | 0.03 | 0.01 | 49 | 81.00 | 20 | 14.06 | 2.8 | 2.91 | 12.62 | 3 | NA | NA | NA | NA | NA | NA |
| 3405 | exec - deriv_nonlpsi.f90:153-155 | deriv_psianl | Single | 0.01 | 0.03 | 0.01 | 39 | 4.00 | 0 | 12.5 | 1 | 1.62 | 8 | 3 | 1 | 1 | 0 | 1 | 0 | NA |
| 3517 | exec - nonlpsi.f90:196-198 | psibnl | Single | 0.01 | 0.05 | 0.02 | 52 | 30.00 | 0 | 12.5 | 1 | 4.71 | 8 | 2.5 | 0 | 1 | 0 | 0 | 0 | NA |
| 4550 | exec - optorb.f90:999-1000 | optorb_define | Innermost | 0.01 | 0.03 | 0.01 | 46 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 3 | 0 | 1 | 0 | 0 | 0 | NA |
| 2683 | exec - multideterminant.f90:610-642 [...] | compute_zmat | InBetween | 0.01 | 0.04 | 0.02 | 51 | 162.00 | 24.48 | 16.14 | 1.82 | 1 | 5.11 | 2 | 1 | 0 | 0 | 13.33 | 0 | NA |
| 3366 | exec - determinante.f90:319-322 | determinante_ref_grad | Single | 0.01 | 0.04 | 0.02 | 52 | 8.00 | 40 | 17.5 | 1.06 | 1.27 | 6.48 | 2 | 0 | 2 | 0 | 4 | 2 | NA |
| 2287 | exec - gammai.f90:74-78 | gammai | Single | 0.01 | 0.02 | 0.01 | 49 | 31.00 | 0 | 12.5 | 1 | 8 | 8 | 2 | 0 | 0 | 0 | 0 | 0 | NA |
| 3987 | exec - multiply_slmi_mderiv.f90:25-26 | multiply_slmi_mderiv_simple | Innermost | 0.01 | 0.03 | 0.01 | 50 | 484.00 | 0 | 12.5 | 1.47 | 1.56 | 8 | 3 | 0 | 3 | 1 | 0 | 0 | NA |
| 2333 | exec - nonloc.f90:77-320 [...] | nonloc | InBetween | 0.01 | 0.03 | 0.01 | 48 | 41.00 | 2.2 | 11.4 | 4.01 | 2.56 | 13.82 | 3 | NA | NA | NA | NA | NA | NA |
| 4263 | exec - detsav.f90:46-101 | detsav | Outermost | 0.01 | 0.05 | 0.02 | 49 | 0.00 | 5.33 | 12.02 | 1 | 1 | 27.39 | 2.5 | NA | NA | NA | NA | NA | NA |
| 2313 | exec - deriv_nonloc.f90:432-434 | deriv_nonlocj_quad4 | Innermost | 0.01 | 0.02 | 0.01 | 45 | 2.00 | 60 | 20 | 2.63 | 2.71 | 7.64 | 2 | 0 | 1 | 2 | 0 | 0 | NA |
| 2622 | exec - multideterminant.f90:100-159 [...] | multideterminant_hpsi | InBetween | 0.01 | 0.03 | 0.01 | 52 | 166.00 | 17.54 | 18.86 | 3.48 | 1 | 5.45 | 3 | NA | NA | NA | NA | NA | NA |
| 2395 | exec - nonloc.f90:795-796 | orbitals_quad | Innermost | 0.01 | 0.03 | 0.01 | 48 | 124.00 | 0 | 12.5 | 1 | 3.2 | 8 | 3 | 1 | 0 | 0 | 0 | 2 | NA |
| 3081 | exec - orbitals.f90:94-583 [...] | orbitals | Outermost | 0.01 | 0.02 | 0.01 | 44 | 2.00 | 1.27 | 11.79 | 1 | 1 | 11.97 | 2 | NA | NA | NA | NA | NA | NA |
| 2316 | exec - deriv_nonloc.f90:406-449 [...] | deriv_nonlocj_quad4 | InBetween | 0.01 | 0.03 | 0.01 | 37 | 0.00 | 0 | 11.25 | 1 | 1 | 12.93 | 3 | 1 | 0 | 3.25 | 1 | 0 | NA |
| 3306 | exec - determinant.f90:88-93 | determinant | Innermost | 0.01 | 0.02 | 0.01 | 45 | 14.00 | 0 | 12.5 | 13.74 | 1 | 8 | 2 | 3 | 0 | 0 | 6 | 0 | NA |
| 3993 | exec - multiply_slmi_mderiv.f90:18-34 [...] | multiply_slmi_mderiv_simple | InBetween | 0.01 | 0.02 | 0.01 | 50 | 199.00 | 43.06 | 17.88 | 1.27 | 1.18 | 5.41 | 2 | 1 | 0 | 0 | 5.67 | 0 | NA |
| 2570 | exec - multideterminante.f90:61-63 | multideterminante | Innermost | 0.01 | 0.02 | 0.01 | 42 | 49.00 | 0 | 12.5 | 1 | 1.5 | 8 | 2 | 0 | 2 | 0 | 0 | 0 | NA |
| 3411 | exec - deriv_nonlpsi.f90:237-239 | deriv_psibnl | Single | 0.01 | 0.04 | 0.02 | 52 | 25.50 | 0 | 12.5 | 1 | 1.62 | 8 | 2 | 1 | 1 | 0 | 1 | 0 | NA |
| 2647 | exec - multideterminant.f90:435-437 | compute_ymat | Innermost | 0.01 | 0.04 | 0.01 | 51 | 6.00 | 0 | 12.5 | 1.29 | 2.12 | 8 | 4 | 0 | 1 | 0 | 2 | 0 | NA |
| 2270 | exec - jassav.f90:53-56 | jassav | Innermost | 0.01 | 0.03 | 0.01 | 50 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 3 | 0 | 0 | 0 | 4 | 0 | NA |
| 2601 | exec - multideterminant.f90:58-305 [...] | multideterminant_hpsi | InBetween | 0.01 | 0.05 | 0.02 | 50 | 0.00 | 18.73 | 14.32 | 7.61 | 3.22 | 12.72 | 2.5 | NA | NA | NA | NA | NA | NA |
| 2555 | exec - multideterminante.f90:37-160 [...] | multideterminante | InBetween | 0.01 | 0.03 | 0.02 | 51 | 3.00 | 4.08 | 12.24 | 1 | 1 | 13.67 | 1.5 | NA | NA | NA | NA | NA | NA |
| 4237 | exec - jastrow4e.f90:131-134 | jastrow4e | Innermost | 0.01 | 0.03 | 0.01 | 49 | 73.00 | 6.45 | 12.5 | 1 | 2.08 | 9.55 | 3 | 1 | 0 | 0 | 2 | 0 | NA |
| 3346 | exec - determinante.f90:52-53 | determinante | Innermost | 0.01 | 0.03 | 0.01 | 47 | 91.00 | 33.33 | 20.83 | 1.06 | 1.36 | 6.33 | 3 | 0 | 2 | 0 | 4 | 0 | NA |
| 2595 | exec - multideterminante.f90:243-244 | multideterminante_grad | Innermost | 0.01 | 0.04 | 0.02 | 52 | 28.50 | 33.33 | 16.67 | 1 | 2.18 | 7.2 | 2 | 0 | 2 | 0 | 2 | 0 | NA |
| 4235 | exec - jastrow4e.f90:55-333 [...] | jastrow4e | Innermost | 0.01 | 0.04 | 0.01 | 48 | 33.00 | 0 | 11.54 | 1.33 | 1.21 | 8.89 | 4 | 2 | 0 | 0 | 0 | 2 | NA |
| 3973 | exec - distances.f90:72-81 | distances | Innermost | 0.01 | 0.02 | 0.01 | 45 | 27.00 | 17.52 | 14.69 | 1 | 1.5 | 2 | 2 | 1 | 0 | 0 | 8 | 0 | NA |
| 5298 | exec - optwf_sr_more.f90:180-182 | atimes_n | Innermost | 0.01 | 0.04 | 0.02 | 48 | 0.00 | 14.29 | 13.39 | 1.28 | 5.05 | 13.71 | 2 | 2 | 2 | 0 | 2 | 0 | NA |
| 4001 | exec - multiply_slmi_mderiv.f90:18-34 [...] | multiply_slmi_mderiv_simple | InBetween | 0.01 | 0.02 | 0.01 | 49 | 165.00 | 0 | 12.2 | 1.59 | 1 | 10.2 | 2 | 1 | 0 | 0 | 9 | 1 | NA |
| 3990 | exec - multiply_slmi_mderiv.f90:25-26 | multiply_slmi_mderiv_simple | Innermost | 0.01 | 0.02 | 0.01 | 52 | 125.00 | 0 | 12.5 | 1 | 2.58 | 8 | 2 | 0 | 2 | 0 | 0 | 0 | NA |
| 2394 | exec - nonloc.f90:460-797 [...] | orbitals_quad | InBetween | 0.01 | 0.03 | 0.01 | 49 | 264.00 | 20.83 | 14.06 | 1.94 | 1.64 | 10.02 | 3 | 0.5 | 0 | 0 | 1.5 | 0.75 | NA |
| 2645 | exec - multideterminant.f90:344-440 [...] | compute_ymat | Outermost | 0.01 | 0.02 | 0.01 | 40 | 6.00 | 0 | 12.17 | 5.7 | 1 | 9.5 | 2 | NA | NA | NA | NA | NA | NA |
| 3996 | exec - multiply_slmi_mderiv.f90:18-35 [...] | multiply_slmi_mderiv_simple | InBetween | 0.01 | 0.02 | 0.01 | 47 | 98.00 | 0 | 12.5 | 1 | 1 | 8 | 2 | NA | NA | NA | NA | NA | NA |
| 2021 | exec - set_input_data.f90:365-365 | multideterminants_define | Innermost | 0.01 | 0.02 | 0.01 | 51 | 0.00 | NA | NA | 1 | NA | NA | 2 | 0 | 1 | 0 | 0 | 0 | NA |
| 4321 | exec - optjas.f90:44-95 [...] | optjas_deloc | InBetween | 0.01 | 0.04 | 0.01 | 36 | 11.00 | 11.18 | 13.71 | 2.88 | 1 | 9.52 | 4 | NA | NA | NA | NA | NA | NA |
| 4209 | exec - hpsi.f90:88-201 [...] | hpsi | InBetween | 0.01 | 0.03 | 0.02 | 52 | 72.50 | 11.44 | 13.71 | 1.48 | 1.49 | 9.49 | 1.5 | 1 | 0 | 1.5 | 2.75 | 0 | NA |
| 3403 | exec - deriv_nonlpsi.f90:157-171 | deriv_psianl | Single | 0.01 | 0.03 | 0.01 | 52 | 166.00 | 12.5 | 13.87 | 1.38 | 1.51 | 10.46 | 3 | NA | NA | NA | NA | NA | NA |
| 2262 | exec - jassav.f90:16-57 [...] | jassav | InBetween | 0.01 | 0.02 | 0.01 | 41 | 0.00 | 0.94 | 11.94 | 2.43 | 1 | 14.23 | 2 | NA | NA | NA | NA | NA | NA |
| 2358 | exec - nonloc.f90:77-186 [...] | nonloc | InBetween | 0.01 | 0.05 | 0.02 | 49 | 3.50 | 19.78 | 15.87 | 3.74 | 2.41 | 10.61 | 2.5 | NA | NA | NA | NA | NA | NA |
| 381 | exec - m_ewald.f90:213-223 [...] | allocate_periodic | Outermost | 0.01 | 0.02 | 0.01 | 44 | 0.00 | 0 | 11.36 | 1 | 1 | 12.14 | 2 | NA | NA | NA | NA | NA | NA |
