Match comparison for N_electrons [step 0] (match type 24579)
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Input 04-lithium.02-absorbing_boundaries.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 3.000000000000000e+00 | 2.000000000000000e-07 | 3.000000000000000e+00 | 1.530076988157186e-15 | 2.999999999999998e+00 | 3.774758283725532e-15 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: 3.0, precision: 0.0000002| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2022a-serial] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_min_autotools: [foss2023a-serial] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_min_autotools: [foss2023b-serial] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_autotools: [foss2022a-serial] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_autotools: [foss2023a-serial] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_autotools: [intel2023a-serial] | 2.999999999999995e+00 | -5.329070518200751e-15 | -2.664535259100376e-08 | PASS |
| foss_autotools: [foss2023b-serial] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 3.000000000000001e+00 | 8.881784197001252e-16 | 4.440892098500626e-09 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 3.000000000000001e+00 | 1.332267629550188e-15 | 6.661338147750939e-09 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 2.999999999999999e+00 | -8.881784197001252e-16 | -4.440892098500626e-09 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 3.000000000000002e+00 | 2.220446049250313e-15 | 1.110223024625157e-08 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 3.000000000000001e+00 | 8.881784197001252e-16 | 4.440892098500626e-09 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 3.000000000000001e+00 | 1.332267629550188e-15 | 6.661338147750939e-09 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | 2.999999999999999e+00 | -1.332267629550188e-15 | -6.661338147750939e-09 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 2.999999999999998e+00 | -1.776356839400250e-15 | -8.881784197001252e-09 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 3.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 2.999999999999995e+00 | -5.329070518200751e-15 | -2.664535259100376e-08 | PASS |