Match comparison for Benzene Energy [step 20] (match type 23475)
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Input 12-tddft-currents-to-maxwell.04-benzene-mxll-td-full-min-coup.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.744565859608992e+01 | 3.740000000000000e-13 | -3.744565859608984e+01 | 1.131526757796700e-13 | -3.744565859608995e+01 | 2.344791028008331e-13 | PASS |
Checks for this match
-
Intel® builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -37.44565859608992, precision: 0.000000000000374| Run | Value | Difference | Relative difference | Status |
| intel-serial: [intel2023a-serial] | -3.744565859609018e+01 | -2.629008122312371e-13 | -7.029433482118638e-01 | PASS |
| foss-serial: [foss2023a-serial] | -3.744565859608974e+01 | 1.847411112976260e-13 | 4.939601906353637e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -3.744565859608974e+01 | 1.847411112976260e-13 | 4.939601906353637e-01 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -3.744565859608991e+01 | 7.105427357601002e-15 | 1.899846887059091e-02 | PASS |
| ppc: [foss2023a-serial] | -3.744565859608979e+01 | 1.350031197944190e-13 | 3.609709085412273e-01 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -3.744565859608983e+01 | 9.237055564881302e-14 | 2.469800953176819e-01 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -3.744565859608983e+01 | 9.237055564881302e-14 | 2.469800953176819e-01 | PASS |
| intel-parallel: [intel2023a-mpi] | -3.744565859608991e+01 | 7.105427357601002e-15 | 1.899846887059091e-02 | PASS |
| foss-parallel: [foss2023a-mpi] | -3.744565859608983e+01 | 9.237055564881302e-14 | 2.469800953176819e-01 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -3.744565859608984e+01 | 7.815970093361102e-14 | 2.089831575765000e-01 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -3.744565859608991e+01 | 7.105427357601002e-15 | 1.899846887059091e-02 | PASS |
| address-sanitizer: [foss2023a-serial, ci-foss-full] | -3.744565859608974e+01 | 1.847411112976260e-13 | 4.939601906353637e-01 | PASS |
| foss-min-parallel: [foss2022a-mpi] | -3.744565859608983e+01 | 9.237055564881302e-14 | 2.469800953176819e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -3.744565859608971e+01 | 2.060573933704291e-13 | 5.509555972471365e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -3.744565859608976e+01 | 1.563194018672220e-13 | 4.179663151530001e-01 | PASS |