options

Loops Index

154 loops have been discarded from the report because their coverage is lower than the threshold set by object_coverage_threshold (0.01%). It represents about 0% of the application. To include them, change the value of object_coverage_threshold in the experiment directory configuration file, then rerun the command with the additionnal parameter --force-static-analysis

Colums Filter

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
Loop idSource LocationSource FunctionLevelCoverage run_0 (%)Max Time Over Threads run_0 (s)Time w.r.t. Wall Time run_0 (s)Nb Threads run_0GFLOPS run_0Vectorization Ratio (%)Vector Length Use (%)Speedup If No Scalar IntegerSpeedup If FP VectorizedSpeedup If Fully VectorizedSpeedup If Perfect Load Balancing run_0Stride 0Stride 1Stride nStride UnknownStride IndirectSpeedup If Data in L1 run_0
3293exec - basis_fns.f90:109-130 [...]basis_fnsInnermost8.292.272.085217.067.6912.987115.21.09100100NA
3085exec - orbitals.f90:94-578 [...]orbitalsInnermost7.31.991.8352826.961005011.3321.0906000NA
2399exec - nonloc.f90:795-796orbitals_quadInnermost3.50.980.8852627.64100501.371.4421.1102100NA
3162exec - orbitals.f90:807-1190 [...]orbitalseInnermost3.190.970.852783.611005011.4521.2105000NA
7926exec - __powidf2Innermost2.310.690.585219.10012.51881.1900000NA
2589exec - multideterminante.f90:259-260multideterminante_gradInnermost2.130.670.545254.93012.511.8981.2601030NA
3294exec - basis_fns.f90:102-103basis_fnsInnermost1.620.480.41528.7316.6713.541114.431.1700010NA
4434exec - optorb.f90:39-87 [...]optorb_derivInBetween1.560.480.395257.77011.733.543.0113.491.23NANANANANANA
7925exec - __powidf2Outermost1.250.430.315214.5806.2511161.3900000NA
4436exec - optorb.f90:69-73optorb_derivInnermost1.160.360.295267.07012.512.3181.24102101NA
2621exec - multideterminant.f90:107-113multideterminant_hpsiInnermost1.130.380.2852195.718.4513.561.061.0681.3615130NA
4329exec - optjas.f90:88-90optjas_delocInnermost1.090.340.275279.7472.5521.5711.144.731.2623002NA
4330exec - optjas.f90:88-90optjas_delocInnermost1.040.320.2652250.191013.751.051.3681.2316020NA
3083exec - orbitals.f90:94-579 [...]orbitalsInBetween0.910.30.2352581.4424.4615.421.762.019.041.31115.750NA
3295exec - basis_fns.f90:93-98basis_fnsInnermost0.680.230.175272.0016.0714.842.23112.021.351002.50NA
2600exec - multideterminante.f90:243-244multideterminante_gradInnermost0.520.190.1352143.088022.51.291.485.941.4604100NA
2596exec - multideterminante.f90:220-249 [...]multideterminante_gradInBetween0.50.170.1352160.0033.8216.641.931.778.861.31NANANANANANA
2654exec - multideterminant.f90:352-357compute_ymatInnermost0.420.150.152111.40012.51.211.6681.501150NA
2315exec - deriv_nonloc.f90:324-449 [...]deriv_nonlocj_quad4InBetween0.40.150.15219.7010.5311.513.251.9612.731.5NANANANANANA
3160exec - orbitals.f90:807-1191 [...]orbitalseOutermost0.390.140.152553.0029.1115.961.492.169.161.410080NA
4236exec - jastrow4e.f90:55-296 [...]jastrow4eOutermost0.380.170.15261.5012.7813.652.472.4110.381.7NANANANANANA
2653exec - multideterminant.f90:353-357compute_ymatInnermost0.360.140.095252.33012.51.521.8581.5600260NA
2625exec - multideterminant.f90:100-159 [...]multideterminant_hpsiInBetween0.360.140.095246.5656.0826.381.18131.561.670032.330NA
3292exec - basis_fns.f90:71-131 [...]basis_fnsInBetween0.350.120.095212.67011.342.331.471.33NANANANANANA
2579exec - multideterminante.f90:61-63multideterminanteInnermost0.320.130.0852264.00100501121.6314400NA
2418exec - nonloc.f90:1192-1195nonlocj_quad4Innermost0.310.130.085211.50011.982.881.8411.151.6310020NA
7831exec - __intel_avx_rep_memsetSingle0.310.120.08520.38100501121.501000NA
2597exec - multideterminante.f90:247-248multideterminante_gradInnermost0.30.120.0852172.25012.51181.509000NA
4433exec - optorb.f90:39-94 [...]optorb_derivOutermost0.280.10.075260.149.7613.724.4181.43NANANANANANA
2588exec - multideterminante.f90:220-263 [...]multideterminante_gradOutermost0.280.110.075260.71012.51181.57NANANANANANA
3334exec - determinant.f90:276-279compute_bmatrices_kinInnermost0.270.10.0752173.431005011.4721.4304000NA
2568exec - multideterminante.f90:61-63multideterminanteInnermost0.260.110.0752260.7148.0818.5111.967.331.8318000NA
2688exec - multideterminant.f90:625-629compute_zmatInnermost0.260.110.075272.14012.512.381.5711380NA
7830exec - __intel_avx_rep_memcpySingle0.250.10.06520.17100501121.6702000NA
3286exec - basis_fns.f90:62-228 [...]basis_fnsOutermost0.250.10.06520.008.6512.326.0219.491.67NANANANANANA
4435exec - optorb.f90:81-84optorb_derivInnermost0.250.110.065265.00012.51.371.5681.83120100NA
2578exec - multideterminante.f90:37-63 [...]multideterminanteInBetween0.240.10.0652254.5042.2218.161.7315.621.6710014.670NA
2598exec - multideterminante.f90:247-248multideterminante_gradInnermost0.240.110.0652103.17100501121.8302100NA
2687exec - multideterminant.f90:623-630compute_zmatInBetween0.230.090.0652113.67813.53.272.0181.5NANANANANANA
4328exec - optjas.f90:44-93 [...]optjas_delocInBetween0.220.090.0552128.6026.5715.642.372.8610.271.81.67007.670NA
2319exec - deriv_nonloc.f90:398-403deriv_nonlocj_quad4Innermost0.220.10.055215.00010.441.961.9813.35211040NA
2397exec - nonloc.f90:460-797 [...]orbitals_quadInBetween0.220.110.0652418.5027.8715.891.791.217.361.8310070NA
2417exec - nonloc.f90:1092-1199 [...]nonlocj_quad4InBetween0.210.10.055216.209.0912.033.352.177.72NANANANANANA
4303exec - optjas.f90:116-122optjas_delocInBetween0.210.110.05526.00011.863.68211.22.2NANANANANANA
2563exec - multideterminante.f90:113-134multideterminanteInnermost0.20.110.055235.6073.520.511.011.195.272.221411NA
6066exec - metrop_mov1_slat.f90:145-785 [...]metrop6Outermost0.20.090.055233.4016.1813.562.272.155.441.8NANANANANANA
2623exec - multideterminant.f90:107-113multideterminant_hpsiInnermost0.190.090.0552297.20012.511.1181.804030NA
2549exec - multideterminante.f90:166-169multideterminanteInnermost0.180.10.045242.50012.511.7882.502041NA
3084exec - orbitals.f90:94-578 [...]orbitalsInnermost0.170.080.0452394.00012.511.338206000NA
2650exec - multideterminant.f90:376-380compute_ymatSingle0.170.070.045234.75012.51.161.6881.7513030NA
2565exec - multideterminante.f90:72-77multideterminanteInnermost0.160.090.045214.0052.6328.291.681.472.942.25100100NA
4331exec - optjas.f90:88-93optjas_delocInBetween0.160.080.0452221.5027.2715.341.871.2711.472100120NA
2471exec - deriv_jastrow4.f90:76-488 [...]deriv_jastrow4Outermost0.150.070.045263.757.5712.782.831.399.361.75NANANANANANA
4277exec - detsav.f90:53-54detsavInnermost0.140.060.04520.00012.51181.500060NA
4302exec - optjas.f90:44-123 [...]optjas_delocInBetween0.130.070.035221.33011.753.119.772.33NANANANANANA
2396exec - nonloc.f90:795-796orbitals_quadInnermost0.130.060.0352216.331005011.542202000NA
2649exec - multideterminant.f90:406-420compute_ymatSingle0.120.060.035262.67012.51.651.958215041NA
2576exec - multideterminante.f90:37-63 [...]multideterminanteInBetween0.120.060.0352483.33012.23.02110.0321007.670NA
3086exec - orbitals.f90:562-579 [...]orbitalsInnermost0.120.050.03520.0006.2511161.6701110NA
7154exec - for_check_mult_overflow64Single0.120.050.03520.00010.721111.891.6710010NA
2575exec - multideterminante.f90:61-63multideterminanteInnermost0.110.050.035297.00012.51181.6705000NA
378exec - m_ewald.f90:223-223allocate_periodicInnermost0.110.040.03510.0006.2511161.3301000NA
4307exec - optjas.f90:103-109optjas_delocInnermost0.110.050.035211.67012.52.351.8281.67111100NA
2348exec - nonloc.f90:258-259nonlocInnermost0.110.040.0352104.331005011.4121.3302000NA
2595exec - multideterminante.f90:243-244multideterminante_gradInnermost0.10.040.025273.5033.3316.6712.187.2202020NA
2381exec - nonloc.f90:379-386distance_quadSingle0.10.060.035238.33012.511.52300030NA
2343exec - nonloc.f90:273-275nonlocInnermost0.10.060.0352350.67100501.091.092202200NA
3190exec - readps_gauss.f90:72-87gauss_potSingle0.10.060.035234.3330.0415.971.282.498.91222.5000NA
2587exec - multideterminante.f90:220-263 [...]multideterminante_gradInBetween0.10.040.03522.0012.514.0610181.33NANANANANANA
4231exec - jastrow4e.f90:55-356 [...]jastrow4eOutermost0.10.050.035247.6711.5714.12.542.496.291.67NANANANANANA
4301exec - optjas.f90:128-131optjas_delocInnermost0.10.050.03520.00012.51181.6702011NA
2599exec - multideterminante.f90:243-244multideterminante_gradInnermost0.090.040.0252398.50012.511.18209001NA
3409exec - deriv_nonlpsi.f90:243-257deriv_psibnlSingle0.090.050.025144.5011.7613.791.31.4110.342.5NANANANANANA
377exec - m_ewald.f90:223-223allocate_periodicInnermost0.090.040.02520.0006.251116201000NA
3082exec - orbitals.f90:580-580orbitalsInnermost0.090.040.02527.00012.51.8818201110NA
2484exec - deriv_jastrow4.f90:194-258deriv_jastrow4Innermost0.090.050.0252148.005.1912.691.261.513.382.5NANANANANANA
2577exec - multideterminante.f90:61-63multideterminanteInnermost0.080.040.025296.5010050112205000NA
4461exec - optorb.f90:171-174optorb_sumInnermost0.080.050.0252100.001005011.1722.506000NA
3999exec - multiply_slmi_mderiv.f90:33-34multiply_slmi_mderiv_simpleInnermost0.080.040.025264.50012.511.548201080NA
4187exec - jastrow4.f90:55-273 [...]jastrow_factor4InBetween0.080.040.025298.5011.4113.172.482.5511.572NANANANANANA
3161exec - orbitals.f90:807-1190 [...]orbitalseInnermost0.080.040.0252728.00012.511.68205000NA
2340exec - nonloc.f90:273-275nonlocInnermost0.080.080.0252249.001005011.412402000NA
2545exec - multideterminante.f90:37-184 [...]multideterminanteOutermost0.080.040.02521.009.2813.054.26113.162NANANANANANA
2286exec - gammai.f90:74-78gammaiSingle0.080.040.025141.00012.5188200000NA
2591exec - multideterminante.f90:220-249 [...]multideterminante_gradInBetween0.080.050.0252104.002014.062.82.9112.622.5NANANANANANA
3517exec - nonlpsi.f90:196-198psibnlSingle0.070.040.025232.00012.514.718201000NA
3411exec - deriv_nonlpsi.f90:237-239deriv_psibnlSingle0.070.040.025230.50012.511.628211010NA
2574exec - multideterminante.f90:37-64 [...]multideterminanteInBetween0.070.040.0252282.00012.3411112NANANANANANA
2679exec - multideterminant.f90:638-641compute_zmatInnermost0.070.040.0252222.50012.51.311.448219200NA
4000exec - multiply_slmi_mderiv.f90:33-34multiply_slmi_mderiv_simpleInnermost0.070.050.0252166.00012.51182.501010NA
4552exec - optorb.f90:991-995optorb_defineInnermost0.070.040.02520.0006.251116201000NA
2321exec - deriv_nonloc.f90:390-391deriv_nonlocj_quad4Innermost0.070.040.025227.5060202.632.717.64201200NA
2467exec - deriv_jastrow4.f90:76-609 [...]deriv_jastrow4InBetween0.070.050.025281.00612.812.112.458.552.5NANANANANANA
4326exec - optjas.f90:44-94 [...]optjas_delocInBetween0.060.040.0152511.0026.4715.632.1318.264NANANANANANA
2468exec - deriv_jastrow4.f90:552-607deriv_jastrow4Innermost0.060.040.025281.503.3512.751.071.712.7122303.750.25NA
3188exec - readps_gauss.f90:23-49getvps_gaussOutermost0.060.040.0152159.0020.7914.163.281.9311.424300100NA
1207exec - optwf_sr.f90:502-507sr_hsInnermost0.060.020.0252129.50012.51.141.338104000NA
3338exec - determinant.f90:263-265compute_bmatrices_kinInnermost0.060.040.0252275.001005011.52205000NA
2585exec - multideterminante.f90:52-54multideterminanteInnermost0.050.030.01470.00012.5118302040NA
2624exec - multideterminant.f90:107-117multideterminant_hpsiInBetween0.050.030.0152579.0038.4617.312.332.3383100100NA
3194exec - determinante_psit.f90:25-26determinante_psitSingle0.050.040.0152292.001005011.52403000NA
3196exec - determinante_psit.f90:29-30determinante_psitSingle0.050.030.0151292.001005011.52303000NA
2582exec - multideterminante.f90:63-64multideterminanteInnermost0.050.040.01460.0010050112401000NA
2613exec - multideterminant.f90:157-163multideterminant_hpsiInnermost0.050.030.014712.0067.3519.91.451.555310060NA
3997exec - multiply_slmi_mderiv.f90:18-34 [...]multiply_slmi_mderiv_simpleInBetween0.050.050.0152125.00012.54.1118510.50.55.51NA
2398exec - nonloc.f90:795-796orbitals_quadInnermost0.050.030.0151973.00012.511.068309000NA
3403exec - deriv_nonlpsi.f90:157-171deriv_psianlSingle0.050.030.0152157.0012.513.871.381.5110.463NANANANANANA
4579exec - get_norbterm.f90:182-186get_norbtermInnermost0.050.030.01500.0006.251116301000NA
4237exec - jastrow4e.f90:131-134jastrow4eInnermost0.050.030.015048.006.4512.512.089.55310020NA
2684exec - multideterminant.f90:638-641compute_zmatInnermost0.050.040.0152512.00100501.251.432414200NA
4439exec - optorb.f90:124-126optorb_computeInnermost0.040.030.014664.0010050112303000NA
4575exec - get_norbterm.f90:59-194 [...]get_norbtermInBetween0.040.020.01470.000101113.822NANANANANANA
2287exec - gammai.f90:74-78gammaiSingle0.040.020.014622.00012.5188200000NA
2333exec - nonloc.f90:77-320 [...]nonlocInBetween0.040.030.014457.002.211.44.012.5613.823NANANANANANA
4183exec - jastrow4.f90:55-336 [...]jastrow_factor4InBetween0.040.030.015083.005.9512.652.642.197.093NANANANANANA
2622exec - multideterminant.f90:100-159 [...]multideterminant_hpsiInBetween0.040.030.0152160.0017.5418.863.4815.453NANANANANANA
4327exec - optjas.f90:88-90optjas_delocInnermost0.040.020.01440.00012.511.318213020NA
2358exec - nonloc.f90:77-186 [...]nonlocInBetween0.040.030.01466.0019.7815.873.742.4110.613NANANANANANA
3390exec - bxmatrices.f90:40-41bxmatrixInnermost0.040.040.01460.0066.6716.671.1317.2402020NA
2581exec - multideterminante.f90:37-65 [...]multideterminanteInBetween0.040.040.01440.00010.971113.03400010NA
3995exec - multiply_slmi_mderiv.f90:18-35 [...]multiply_slmi_mderiv_simpleInBetween0.030.020.0144105.00012.33118.152NANANANANANA
2683exec - multideterminant.f90:610-642 [...]compute_zmatInBetween0.030.020.0147162.0024.4816.141.8215.11210013.330NA
4297exec - optjas.f90:154-157optjas_delocInnermost0.030.020.0149336.001005011.52205000NA
2593exec - multideterminante.f90:247-248multideterminante_gradInnermost0.030.030.014448.001005011.252302000NA
2265exec - jassav.f90:33-39jassavInnermost0.030.020.01400.00012.5118200040NA
3982exec - distances.f90:51-58distancesSingle0.030.020.01380.0028.5715.181.92111.29212030NA
3998exec - multiply_slmi_mderiv.f90:33-34multiply_slmi_mderiv_simpleInnermost0.030.030.015074.00012.512.918301010NA
4211exec - hpsi.f90:198-200hpsiInnermost0.030.020.014849.0027.2720.452.131.596.53212310NA
2590exec - multideterminante.f90:220-251 [...]multideterminante_gradOutermost0.030.030.014768.00012.16119.173NANANANANANA
3405exec - deriv_nonlpsi.f90:153-155deriv_psianlSingle0.030.030.01443.00012.511.628311010NA
3987exec - multiply_slmi_mderiv.f90:25-26multiply_slmi_mderiv_simpleInnermost0.030.030.0151524.00012.51.471.568303100NA
4549exec - optorb.f90:880-1005 [...]optorb_defineInBetween0.030.020.01430.0009.661113.782NANANANANANA
2580exec - multideterminante.f90:63-64multideterminanteInnermost0.030.020.01400.0006.251116201000NA
2651exec - multideterminant.f90:344-357 [...]compute_ymatOutermost0.030.030.015045.00012.226.422.4611.953NANANANANANA
4235exec - jastrow4e.f90:55-333 [...]jastrow4eInnermost0.030.030.014637.00011.541.331.218.89320002NA
2316exec - deriv_nonloc.f90:406-449 [...]deriv_nonlocj_quad4InBetween0.030.030.01330.00011.251112.933103.2510NA
2592exec - multideterminante.f90:247-248multideterminante_gradInnermost0.030.020.014875.00012.511.258202000NA
3990exec - multiply_slmi_mderiv.f90:25-26multiply_slmi_mderiv_simpleInnermost0.030.020.0149109.00012.512.588202000NA
3993exec - multiply_slmi_mderiv.f90:18-34 [...]multiply_slmi_mderiv_simpleInBetween0.030.030.0149158.0043.0617.881.271.185.4131005.670NA
3342exec - determinante.f90:38-59 [...]determinanteInBetween0.030.030.014335.0021.7414.43.442.9511.673NANANANANANA
2611exec - multideterminant.f90:188-236 [...]multideterminant_hpsiInnermost0.030.020.014840.0073.4520.911.145.03222321NA
2383exec - nonloc.f90:460-846 [...]orbitals_quadInBetween0.030.020.014536.005.7112.865.38110.422NANANANANANA
2630exec - multideterminant.f90:272-278multideterminant_hpsiInnermost0.030.020.014942.00012.51.131.598200082NA
4272exec - detsav.f90:70-71detsavInnermost0.030.020.01430.00012.5118208000NA
3387exec - bxmatrices.f90:40-41bxmatrixInnermost0.030.020.01460.0066.6716.671.1317.2202020NA
3996exec - multiply_slmi_mderiv.f90:18-35 [...]multiply_slmi_mderiv_simpleInBetween0.030.020.0149102.00012.51182NANANANANANA
3991exec - multiply_slmi_mderiv.f90:18-27 [...]multiply_slmi_mderiv_simpleInBetween0.020.010.014886.003515.942.171.7910.26110021NA
2572exec - multideterminante.f90:37-63 [...]multideterminanteInBetween0.020.020.014389.00012.53.518210030NA
2309exec - deriv_nonloc.f90:282-455 [...]deriv_nonlocj_quad4Outermost0.020.020.014421.0016.2511.884.831.9113.142NANANANANANA
3988exec - multiply_slmi_mderiv.f90:18-36multiply_slmi_mderiv_simpleOutermost0.020.020440.00011.511102NANANANANANA
3346exec - determinante.f90:52-53determinanteInnermost0.020.020.013955.0033.3320.831.061.366.33202040NA
4577exec - get_norbterm.f90:190-191get_norbtermInnermost0.020.010380.0006.251116101000NA
4266exec - detsav.f90:96-100detsavInnermost0.020.010300.00012.5118101030NA
3081exec - orbitals.f90:94-583 [...]orbitalsOutermost0.020.020.01343.001.2711.791111.972NANANANANANA
4185exec - jastrow4.f90:314-318jastrow_factor4Innermost0.020.020470.00011.741.221.148.62220002NA
3296exec - basis_fns.f90:71-71basis_fnsInnermost0.020.010330.0006.251116101000NA
6073exec - metrop_mov1_slat.f90:349-355metrop6Innermost0.020.030.014726.0040.2517.21.192.37.2931.50020NA
4276exec - detsav.f90:51-55detsavInBetween0.020.010350.004131181NANANANANANA
2569exec - multideterminante.f90:37-64 [...]multideterminanteInBetween0.020.020.014346.00012.24118.192NANANANANANA
381exec - m_ewald.f90:213-223 [...]allocate_periodicOutermost0.020.020310.00011.361112.142NANANANANANA
4209exec - hpsi.f90:88-201 [...]hpsiInBetween0.020.020.014572.0011.4413.711.481.499.492101.52.750NA
3971exec - distances.f90:72-81distancesInnermost0.020.010400.00012.511.52000030NA
2554exec - multideterminante.f90:164-164multideterminanteInnermost0.020.020.01320.0010050112201000NA
3306exec - determinant.f90:88-93determinantInnermost0.020.020.014110.00012.513.7418230060NA
3994exec - multiply_slmi_mderiv.f90:25-26multiply_slmi_mderiv_simpleInnermost0.020.020320.00100501.371.442202100NA
3305exec - determinant.f90:67-78determinantInnermost0.020.020310.00011.681115.1230050NA
2313exec - deriv_nonloc.f90:432-434deriv_nonlocj_quad4Innermost0.020.030320.0060202.632.717.64301200NA
3985exec - distances.f90:275-290 [...]distancese_restoreSingle0.020.010260.0011.1113.892.0517.6410.50.5020NA
2601exec - multideterminant.f90:58-305 [...]multideterminant_hpsiInBetween0.020.020.01361.0018.7314.327.613.2212.722NANANANANANA
2632exec - multideterminant.f90:272-278multideterminant_hpsiInnermost0.020.020.01360.00012.5118202011NA
2546exec - multideterminante.f90:180-181multideterminanteInnermost0.020.020.01360.00012.5118201030NA
4263exec - detsav.f90:46-101detsavOutermost0.020.020.01330.005.3312.021127.392NANANANANANA
2673exec - multideterminant.f90:479-485compute_dymatSingle0.020.020380.00012.52.072.428210150NA
2567exec - multideterminante.f90:37-65 [...]multideterminanteInBetween0.020.010300.00012.251181NANANANANANA
2366exec - nonloc.f90:151-168nonlocInnermost0.020.020.014529.003.8511.783.422.4412.652101100NA
2416exec - nonloc.f90:1204-1207nonlocj_quad4Innermost0.020.020400.00011.882.51.611.43210020NA
3297exec - basis_fns.f90:71-71basis_fnsInnermost0.020.020280.0010050112201000NA
3969exec - distances.f90:133-146distancesSingle0.020.020430.00012.51.251.882.5211310NA
2570exec - multideterminante.f90:61-63multideterminanteInnermost0.020.030320.00012.511.58302000NA
4001exec - multiply_slmi_mderiv.f90:18-34 [...]multiply_slmi_mderiv_simpleInBetween0.020.030.0150164.00012.21.59110.2310091NA
5298exec - optwf_sr_more.f90:180-182atimes_nInnermost0.020.010.01360.0014.2913.391.285.0513.71122020NA
2314exec - deriv_nonloc.f90:422-427deriv_nonlocj_quad4Innermost0.020.010400.0014.2913.392.73.1812.39120030NA
3513exec - nonlpsi.f90:143-145psianlSingle0.020.010250.00012.514.718101000NA
4551exec - optorb.f90:999-1000optorb_defineInnermost0.010.010260.0006.251116101000NA
2285exec - gammai.f90:94-106gammaiSingle0.010.020350.00011.9815.459.23000000NA
3339exec - determinante.f90:38-64determinanteOutermost0.010.010200.0015.3813.464.793.1312.761NANANANANANA
2838exec - jastrowe.f90:45-48jastroweInnermost0.010.010200.00012.5118101040NA
3189exec - readps_gauss.f90:40-48getvps_gaussInnermost0.010.020280.0022.2214.244.692.4912211121NA
3343exec - determinante.f90:52-53determinanteInnermost0.010.010400.00012.513.28002010NA
7404exec - for_indexOutermost0.010.010220.0006.2511160NANANANANANA
2347exec - nonloc.f90:77-260 [...]nonlocInBetween0.0100220.00012.52.643.76801007.670NA
2682exec - multideterminant.f90:638-641compute_zmatInnermost0.010.010190.001005011.332004000NA
3344exec - determinante.f90:56-57determinanteInnermost0.010.020250.00012.511.758003000NA
4294exec - optjas.f90:168-169optjas_delocInnermost0.010.010280.0066.6722.0211.174.79111002NA
2550exec - multideterminante.f90:169-169multideterminanteInnermost0.010.010190.00NANA1NANA100000NA
2672exec - multideterminant.f90:497-532compute_dymatSingle0.010.010390.00012.51.522.528014122NA
3973exec - distances.f90:72-81distancesInnermost0.010.010390.0017.5214.6911.52010080NA
3333exec - determinant.f90:276-279compute_bmatrices_kinInnermost0.010.010220.00012.51.111.678000004NA
2616exec - multideterminant.f90:86-159 [...]multideterminant_hpsiInBetween0.010.010180.0020.0917.152.7915.871NANANANANANA
4622exec - optci.f90:56-58optci_delocInnermost0.010.010220.001005011.422006000NA
2522exec - hpsie.f90:57-61psieInnermost0.010.010140.00012.51.3618001010NA
2472exec - deriv_jastrow4.f90:135-136deriv_jastrow4Innermost0.010.010170.0006.251116000080NA
2620exec - multideterminant.f90:107-113multideterminant_hpsiInnermost0.010.010310.0079.4122.4311.124.5023002NA
2326exec - deriv_nonloc.f90:286-288deriv_nonlocj_quad4Innermost0.010.010270.0012.514.06117.5110000NA
3967exec - distances.f90:96-105distancesInnermost0.010.010330.00012.511.52002010NA
403exec - m_ewald.f90:342-342allocate_tempor_testInnermost0.010.010200.0006.251116001000NA
3984exec - distances.f90:30-34distancesSingle0.010.010310.0033.3316.67116111060NA
2404exec - nonloc.f90:881-903 [...]nonlocd_quadOutermost0.010.010260.0037.0415.972.633.3512.071NANANANANANA
2332exec - nonloc.f90:77-322 [...]nonlocOutermost0.010.010140.0023.0814.92.672.7611.911NANANANANANA
2338exec - nonloc.f90:77-276 [...]nonlocInBetween0.010.010240.00011.462.181.7612.3500.7501.50.750NA
1208exec - optwf_sr.f90:497-500sr_hsInnermost0.010.010350.00012.51.141.338004000NA
2470exec - deriv_jastrow4.f90:526-530deriv_jastrow4Innermost0.010.020350.009.5212.9512.439.31010020NA
4210exec - hpsi.f90:198-200hpsiInnermost0.010.010290.00012.512.678102010NA
7308exec - for_cpstrSingle0.010.010180.0009.381113.71101000NA
2686exec - multideterminant.f90:610-631 [...]compute_zmatInBetween0.010.010190.003.5112.287.65110.831NANANANANANA
4621exec - optci.f90:65-68optci_delocInnermost0.010.020250.0010050112205000NA
2320exec - deriv_nonloc.f90:390-391deriv_nonlocj_quad4Innermost0.010.010100.00012.51.21.58101010NA
3345exec - determinante.f90:56-57determinanteInnermost0.010.010250.001005011.412003000NA
2414exec - nonloc.f90:1092-1226 [...]nonlocj_quad4Outermost0.010.010230.0011.3611.794.391.4912.520NANANANANANA
4198exec - jastrow4.f90:128-138 [...]jastrow_factor4Innermost0.010.010340.00512.3412.369.31010020NA
2336exec - nonloc.f90:77-277 [...]nonlocInBetween0.010.010380.003.0312.3110.882.7213.860NANANANANANA
2356exec - nonloc.f90:77-186 [...]nonlocInBetween0.010.010260.005.7713.76.68112.121NANANANANANA
3992exec - multiply_slmi_mderiv.f90:25-26multiply_slmi_mderiv_simpleInnermost0.010.020370.001005011.542002000NA
4299exec - optjas.f90:44-137 [...]optjas_delocInBetween0.010.010250.00012.139.391.8613.171NANANANANANA
2594exec - multideterminante.f90:243-244multideterminante_gradInnermost0.010.010330.00012.512.918002001NA
2269exec - jassav.f90:19-22jassavInnermost0.010.010150.00012.5118100040NA
2837exec - jastrowe.f90:42-51jastroweOutermost0.010.020230.00011.494.81114.572NANANANANANA
2341exec - nonloc.f90:77-276 [...]nonlocInBetween0.010.010240.0018.115.081.7418.3601008.750NA
3366exec - determinante.f90:319-322determinante_ref_gradSingle0.010.020280.004017.51.061.276.48202042NA
2284exec - gammai.f90:94-106gammaiSingle0.010.010290.00011.981.013.033.03000000NA
3096exec - orbitals.f90:94-581 [...]orbitalsInBetween0.010.010190.005.8812.131112.521NANANANANANA
2270exec - jassav.f90:53-56jassavInnermost0.010.010250.00012.5118100040NA
3348exec - determinante.f90:42-43determinanteInnermost0.010.010160.0033.3320.831.061.366.33102040NA
2339exec - nonloc.f90:273-275nonlocInnermost0.010.010240.00012.51.222.758000011NA
4321exec - optjas.f90:44-95 [...]optjas_delocInBetween0.010.010230.0011.1813.712.8819.521NANANANANANA
4289exec - optjas.f90:44-176 [...]optjas_delocOutermost0.010.010180.005.3812.58.62111.10NANANANANANA
3331exec - determinant.f90:257-281 [...]compute_bmatrices_kinInBetween0.010.010170.00012.171114.171NANANANANANA
3332exec - determinant.f90:257-280 [...]compute_bmatrices_kinInBetween0.010.020360.00011.962.46111.2121004.750NA
4269exec - detsav.f90:86-89detsavInnermost0.010.010170.00012.5118101040NA
2311exec - deriv_nonloc.f90:429-449 [...]deriv_nonlocj_quad4InBetween0.010.010140.00010.921113.01010.53.250.50NA
4298exec - optjas.f90:44-147 [...]optjas_delocInBetween0.010.010300.006.1913.475.219.771NANANANANANA
2419exec - nonloc.f90:1117-1119nonlocj_quad4Innermost0.010.010220.00012.5118110000NA
387exec - m_ewald.f90:222-222allocate_periodicInnermost0.010.010180.0006.251116001000NA
404exec - m_ewald.f90:342-342allocate_tempor_testInnermost0.0100170.0006.251116001000NA
6064exec - metrop_mov1_slat.f90:254-258metrop6Innermost0.010.020340.0020151.251.363.33250001NA
2573exec - multideterminante.f90:61-63multideterminanteInnermost0.010.010390.001005011.412002000NA
2486exec - deriv_jastrow4.f90:172-176deriv_jastrow4Innermost0.010.010320.00011.6812.299.23010020NA
6044exec - metrop_mov1_slat.f90:770-772metrop6Innermost0.010.010160.00012.51.251.528101120NA
2394exec - nonloc.f90:460-797 [...]orbitals_quadInBetween0.010.020220.0020.8314.061.941.6410.0200.5001.50.75NA
2262exec - jassav.f90:16-57 [...]jassavInBetween0.010.010260.000.9411.942.43114.231NANANANANANA
3386exec - bxmatrices.f90:28-42 [...]bxmatrixOutermost0.010.010120.00011.591113.2111004.670NA
3079exec - orbitals.f90:94-583 [...]orbitalsInBetween0.010.010110.009.2112.754.49111.041NANANANANANA
2586exec - multideterminante.f90:240-263 [...]multideterminante_gradInnermost0.010.010230.0014.2914.292.331.1780NANANANANANA
3989exec - multiply_slmi_mderiv.f90:33-35multiply_slmi_mderiv_simpleInnermost0.010.010270.0006.251116000030NA
3970exec - distances.f90:118-128distancesSingle0.010.020370.00012.511.52002010NA
×