Match comparison for Benzene Multipoles [step 20] (match type 20286)
Commits >
Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 >
Input 12-tddft-currents-to-maxwell.02-benzene-mxll-td-length-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.094497332627963e-02 | 9.000000000000000e-07 | -2.094508926211479e-02 | 6.489179378133808e-15 | -2.094508926211473e-02 | 1.322206233389522e-14 | PASS |
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Detailed information
Reference: -0.020944973326279627, precision: 0.0000009| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -2.094508926211696e-02 | -1.159358373331587e-07 | -1.288175970368430e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -2.094508926211696e-02 | -1.159358373331587e-07 | -1.288175970368430e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -2.094508926210607e-02 | -1.159358264460342e-07 | -1.288175849400380e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| intel-serial: [intel2023a-serial] | -2.094508926211555e-02 | -1.159358359245632e-07 | -1.288175954717369e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -2.094508926210948e-02 | -1.159358298530311e-07 | -1.288175887255901e-01 | PASS |
| foss-ppc: [foss2022a-serial] | -2.094508926211173e-02 | -1.159358321012327e-07 | -1.288175912235919e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.094508926212173e-02 | -1.159358421036483e-07 | -1.288176023373870e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -2.094508926210960e-02 | -1.159358299709923e-07 | -1.288175888566581e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -2.094508926210960e-02 | -1.159358299709923e-07 | -1.288175888566581e-01 | PASS |
| intel-omp: [intel2023a-serial] | -2.094508926211956e-02 | -1.159358399283050e-07 | -1.288175999203389e-01 | PASS |
| intel-omp: [intel2022a-serial] | -2.094508926211956e-02 | -1.159358399283050e-07 | -1.288175999203389e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -2.094508926210150e-02 | -1.159358218767725e-07 | -1.288175798630806e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -2.094508926210960e-02 | -1.159358299709923e-07 | -1.288175888566581e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -2.094508926210960e-02 | -1.159358299709923e-07 | -1.288175888566581e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -2.094508926210938e-02 | -1.159358297524171e-07 | -1.288175886137968e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -2.094508926210938e-02 | -1.159358297524171e-07 | -1.288175886137968e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -2.094508926211663e-02 | -1.159358370000918e-07 | -1.288175966667687e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -2.094508926211119e-02 | -1.159358315669379e-07 | -1.288175906299310e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -2.094508926210960e-02 | -1.159358299709923e-07 | -1.288175888566581e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -2.094508926210938e-02 | -1.159358297524171e-07 | -1.288175886137968e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -2.094508926210938e-02 | -1.159358297524171e-07 | -1.288175886137968e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -2.094508926210354e-02 | -1.159358239133379e-07 | -1.288175821259310e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -2.094508926212795e-02 | -1.159358483208972e-07 | -1.288176092454413e-01 | PASS |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -2.094508926211555e-02 | -1.159358359245632e-07 | -1.288175954717369e-01 | PASS |