Match comparison for Energy [step 0] (match type 29345)
Commits >
Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a >
Input 24-adsic_freeze_orbitals.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.013509098871849e+00 | 6.590000000000000e-14 | -2.013509098871799e+00 | 2.080166560298011e-14 | -2.013509098871849e+00 | 5.995204332975845e-14 | PASS |
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Detailed information
Reference: -2.013509098871849, precision: 0.0000000000000659| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | -2.013509098871801e+00 | 4.840572387365683e-14 | 7.345329874606499e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | -2.013509098871798e+00 | 5.062616992290714e-14 | 7.682271611973769e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -2.013509098871801e+00 | 4.840572387365683e-14 | 7.345329874606499e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | -2.013509098871798e+00 | 5.062616992290714e-14 | 7.682271611973769e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -2.013509098871798e+00 | 5.062616992290714e-14 | 7.682271611973769e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -2.013509098871801e+00 | 4.840572387365683e-14 | 7.345329874606499e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -2.013509098871798e+00 | 5.062616992290714e-14 | 7.682271611973769e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -2.013509098871798e+00 | 5.062616992290714e-14 | 7.682271611973769e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -2.013509098871797e+00 | 5.151434834260726e-14 | 7.817048306920678e-01 | PASS |
| foss_autotools: [foss2023a-serial] | -2.013509098871798e+00 | 5.062616992290714e-14 | 7.682271611973769e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -2.013509098871794e+00 | 5.462297281155770e-14 | 8.288766739234856e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -2.013509098871794e+00 | 5.462297281155770e-14 | 8.288766739234856e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -2.013509098871796e+00 | 5.284661597215745e-14 | 8.019213349341039e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -2.013509098871796e+00 | 5.284661597215745e-14 | 8.019213349341039e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -2.013509098871791e+00 | 5.817568649035820e-14 | 8.827873519022489e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -2.013509098871791e+00 | 5.817568649035820e-14 | 8.827873519022489e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -2.013509098871798e+00 | 5.062616992290714e-14 | 7.682271611973769e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -2.013509098871792e+00 | 5.684341886080801e-14 | 8.625708476602126e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -2.013509098871791e+00 | 5.817568649035820e-14 | 8.827873519022489e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -2.013509098871789e+00 | 5.995204332975845e-14 | 9.097426908916305e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -2.013509098871791e+00 | 5.773159728050814e-14 | 8.760485171549035e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -2.013509098871909e+00 | -5.995204332975845e-14 | -9.097426908916305e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -2.013509098871790e+00 | 5.861977570020827e-14 | 8.895261866495943e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -2.013509098871790e+00 | 5.861977570020827e-14 | 8.895261866495943e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -2.013509098871790e+00 | 5.861977570020827e-14 | 8.895261866495943e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -2.013509098871797e+00 | 5.195843755245733e-14 | 7.884436654394131e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -2.013509098871791e+00 | 5.817568649035820e-14 | 8.827873519022489e-01 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | -2.013509098871821e+00 | 2.842170943040401e-14 | 4.312854238301063e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -2.013509098871793e+00 | 5.639932965095795e-14 | 8.558320129128673e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -2.013509098871793e+00 | 5.551115123125783e-14 | 8.423543434181764e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -2.013509098871794e+00 | 5.462297281155770e-14 | 8.288766739234856e-01 | PASS |