Match comparison for Energy [step 100] (match type 29346)
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Input 24-adsic_freeze_orbitals.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.975208529592941e+00 | 1.000000000000000e-04 | -1.975208529592934e+00 | 7.071997257696214e-15 | -1.975208529592935e+00 | 1.165734175856414e-14 | PASS |
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Detailed information
Reference: -1.9752085295929414, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2022a-serial] | -1.975208529592927e+00 | 1.465494392505207e-14 | 1.465494392505207e-10 | PASS |
| foss_min_autotools: [foss2023a-serial] | -1.975208529592927e+00 | 1.465494392505207e-14 | 1.465494392505207e-10 | PASS |
| foss_min_autotools: [foss2023b-serial] | -1.975208529592927e+00 | 1.465494392505207e-14 | 1.465494392505207e-10 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -1.975208529592925e+00 | 1.598721155460225e-14 | 1.598721155460225e-10 | PASS |
| foss_autotools: [foss2022a-serial] | -1.975208529592927e+00 | 1.465494392505207e-14 | 1.465494392505207e-10 | PASS |
| foss_autotools: [foss2023a-serial] | -1.975208529592927e+00 | 1.465494392505207e-14 | 1.465494392505207e-10 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -1.975208529592925e+00 | 1.598721155460225e-14 | 1.598721155460225e-10 | PASS |
| intel_autotools: [intel2023a-serial] | -1.975208529592931e+00 | 1.065814103640150e-14 | 1.065814103640150e-10 | PASS |
| foss_autotools: [foss2023b-serial] | -1.975208529592927e+00 | 1.465494392505207e-14 | 1.465494392505207e-10 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -1.975208529592925e+00 | 1.598721155460225e-14 | 1.598721155460225e-10 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -1.975208529592936e+00 | 5.551115123125783e-15 | 5.551115123125783e-11 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -1.975208529592940e+00 | 1.332267629550188e-15 | 1.332267629550188e-11 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | -1.975208529592936e+00 | 4.884981308350689e-15 | 4.884981308350689e-11 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -1.975208529592941e+00 | 6.661338147750939e-16 | 6.661338147750939e-12 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -1.975208529592936e+00 | 5.551115123125783e-15 | 5.551115123125783e-11 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -1.975208529592941e+00 | 4.440892098500626e-16 | 4.440892098500626e-12 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -1.975208529592941e+00 | 4.440892098500626e-16 | 4.440892098500626e-12 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -1.975208529592947e+00 | -5.329070518200751e-15 | -5.329070518200751e-11 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -1.975208529592927e+00 | 1.465494392505207e-14 | 1.465494392505207e-10 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | -1.975208529592936e+00 | 4.884981308350689e-15 | 4.884981308350689e-11 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -1.975208529592941e+00 | 6.661338147750939e-16 | 6.661338147750939e-12 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -1.975208529592941e+00 | 6.661338147750939e-16 | 6.661338147750939e-12 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -1.975208529592946e+00 | -4.218847493575595e-15 | -4.218847493575595e-11 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -1.975208529592929e+00 | 1.199040866595169e-14 | 1.199040866595169e-10 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -1.975208529592941e+00 | 4.440892098500626e-16 | 4.440892098500626e-12 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -1.975208529592936e+00 | 5.329070518200751e-15 | 5.329070518200751e-11 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -1.975208529592940e+00 | 1.554312234475219e-15 | 1.554312234475219e-11 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | -1.975208529592923e+00 | 1.798561299892754e-14 | 1.798561299892754e-10 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -1.975208529592927e+00 | 1.421085471520200e-14 | 1.421085471520200e-10 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -1.975208529592936e+00 | 4.884981308350689e-15 | 4.884981308350689e-11 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -1.975208529592943e+00 | -1.998401444325282e-15 | -1.998401444325282e-11 | PASS |