Match comparison for Forces [step 5] (match type 22545)
Commits >
Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 >
Input 05-time_propagation.06-td_fast_md.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -7.618874990413800e-03 | 4.420000000000000e-14 | -7.618874990418328e-03 | 9.908662747764101e-15 | -7.618874990430458e-03 | 2.353672812205332e-14 | PASS |
Checks for this match
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Detailed information
Reference: -0.0076188749904138, precision: 0.0000000000000442| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -7.618874990416913e-03 | -3.112961277640380e-15 | -7.042898818190906e-02 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -7.618874990416913e-03 | -3.112961277640380e-15 | -7.042898818190906e-02 | PASS |
| foss-ppc: [foss2022a-serial] | -7.618874990433788e-03 | -1.998835125194276e-14 | -4.522251414466688e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -7.618874990417801e-03 | -4.001139697340506e-15 | -9.052352256426484e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -7.618874990412472e-03 | 1.327930820860246e-15 | 3.004368372986982e-02 | PASS |
| foss-serial-full: [foss2023a-serial] | -7.618874990414470e-03 | -6.704706234650359e-16 | -1.516901863043068e-02 | PASS |
| foss-serial-full: [foss2023b-serial] | -7.618874990414470e-03 | -6.704706234650359e-16 | -1.516901863043068e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -7.618874990407143e-03 | 6.657001339060997e-15 | 1.506108900240045e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -7.618874990407143e-03 | 6.657001339060997e-15 | 1.506108900240045e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -7.618874990414470e-03 | -6.704706234650359e-16 | -1.516901863043068e-02 | PASS |
| foss-serial-debug: [foss2023a-serial] | -7.618874990414470e-03 | -6.704706234650359e-16 | -1.516901863043068e-02 | PASS |
| foss-serial-min: [foss2023a-serial] | -7.618874990414470e-03 | -6.704706234650359e-16 | -1.516901863043068e-02 | PASS |
| foss-serial-min: [foss2023b-serial] | -7.618874990414470e-03 | -6.704706234650359e-16 | -1.516901863043068e-02 | PASS |
| foss-opt-full: [foss2023a-serial] | -7.618874990415803e-03 | -2.002738253015224e-15 | -4.531082020396434e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -7.618874990415803e-03 | -2.002738253015224e-15 | -4.531082020396434e-02 | PASS |
| intel-serial: [intel2023a-serial] | -7.618874990406921e-03 | 6.879045943986029e-15 | 1.556345236195934e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -7.618874990415803e-03 | -2.002738253015224e-15 | -4.531082020396434e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -7.618874990411806e-03 | 1.994064635635340e-15 | 4.511458451663665e-02 | PASS |
| foss-omp-full: [foss2023a-serial] | -7.618874990414470e-03 | -6.704706234650359e-16 | -1.516901863043068e-02 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -7.618874990419577e-03 | -5.777496536740756e-15 | -1.307125913289764e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -7.618874990419577e-03 | -5.777496536740756e-15 | -1.307125913289764e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -7.618874990422464e-03 | -8.664076400766163e-15 | -1.960198280716327e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -7.618874990419577e-03 | -5.777496536740756e-15 | -1.307125913289764e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -7.618874990416469e-03 | -2.668872067790318e-15 | -6.038172099073117e-02 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -7.618874990422464e-03 | -8.664076400766163e-15 | -1.960198280716327e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -7.618874990416025e-03 | -2.224782857940255e-15 | -5.033445379955329e-02 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -7.618874990416469e-03 | -2.668872067790318e-15 | -6.038172099073117e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -7.618874990416025e-03 | -2.224782857940255e-15 | -5.033445379955329e-02 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -7.618874990421132e-03 | -7.331808771215975e-15 | -1.658780264980990e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -7.618874990413804e-03 | -4.336808689942018e-18 | -9.811784366384656e-05 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -7.618874990453994e-03 | -4.019441030012061e-14 | -9.093757986452627e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -7.618874990449331e-03 | -3.553147359669495e-14 | -8.038794931378949e-01 | PASS |