Match comparison for Benzene Multipoles [step 20] (match type 30137)
Commits >
Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 >
Input 12-tddft-currents-to-maxwell.03-benzene-mxll-td-veloc-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.094497201627904e-02 | 1.670000000000000e-14 | -2.094497201627716e-02 | 6.526995080858566e-15 | -2.094497201627641e-02 | 1.239633395933026e-14 | PASS |
Checks for this match
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Detailed information
Reference: -0.02094497201627904, precision: 0.0000000000000167| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -2.094497201627920e-02 | -1.561251128379126e-16 | -9.348809151970816e-03 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -2.094497201627938e-02 | -3.434752482434078e-16 | -2.056738013433580e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -2.094497201626778e-02 | 1.125835535908948e-14 | 6.741530155143399e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| intel-serial: [intel2023a-serial] | -2.094497201627776e-02 | 1.280225925270884e-15 | 7.666023504616069e-02 | PASS |
| foss-serial-full: [foss2023b-serial] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -2.094497201627184e-02 | 7.195632978351796e-15 | 4.308762262486105e-01 | PASS |
| foss-ppc: [foss2022a-serial] | -2.094497201627428e-02 | 4.756611771128405e-15 | 2.848270521633776e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.094497201628445e-02 | -5.412337245047638e-15 | -3.240920506016550e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -2.094497201627198e-02 | 7.056855100273651e-15 | 4.225661736690809e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -2.094497201627198e-02 | 7.056855100273651e-15 | 4.225661736690809e-01 | PASS |
| intel-omp: [intel2023a-serial] | -2.094497201628231e-02 | -3.268219028740305e-15 | -1.957017382479224e-01 | PASS |
| intel-omp: [intel2022a-serial] | -2.094497201628231e-02 | -3.268219028740305e-15 | -1.957017382479224e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -2.094497201626401e-02 | 1.502617474891110e-14 | 8.997709430485690e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -2.094497201627198e-02 | 7.056855100273651e-15 | 4.225661736690809e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -2.094497201627198e-02 | 7.056855100273651e-15 | 4.225661736690809e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -2.094497201627167e-02 | 7.365635878997523e-15 | 4.410560406585343e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -2.094497201627167e-02 | 7.365635878997523e-15 | 4.410560406585343e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -2.094497201627768e-02 | 1.356553758213863e-15 | 8.123076396490198e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -2.094497201627397e-02 | 5.068861996804230e-15 | 3.035246704673192e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -2.094497201627198e-02 | 7.056855100273651e-15 | 4.225661736690809e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -2.094497201627167e-02 | 7.365635878997523e-15 | 4.410560406585343e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -2.094497201627167e-02 | 7.365635878997523e-15 | 4.410560406585343e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -2.094497201626601e-02 | 1.303471219848973e-14 | 7.805216885323191e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -2.094497201628881e-02 | -9.766493169749424e-15 | -5.848199502843966e-01 | PASS |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -2.094497201627708e-02 | 1.960237527853792e-15 | 1.173794926858558e-01 | PASS |