Match comparison for Multipoles [step 20] (match type 12078)
Commits >
Commit 0eb882d93dcc47f8554e98f5f256d6c6053dae9c >
Input 14-fullerene_unpacked.03-td-packed.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.020315146839614e+00 | 5.140000000000000e-06 | -2.020314128413254e+00 | 1.601047509941114e-06 | -2.020315170040013e+00 | 1.951144168899077e-06 | PASS |
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Detailed information
Reference: -2.0203151468396143, precision: 0.00000514| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_min | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-01 | PASS |
| cmake_foss_2022a_full_serial | -2.020313218895844e+00 | 1.927943769963747e-06 | 3.750863365688223e-01 | PASS |
| spack_foss-2022a_serial_min | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-01 | PASS |
| spack_foss-2023a_serial_opt | -2.020313218895844e+00 | 1.927943769963747e-06 | 3.750863365688223e-01 | PASS |
| spack_foss-2022a_serial | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-01 | PASS |
| spack_foss-2023a_serial | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-01 | PASS |
| spack_foss-2022a_ppc | -2.020313308059224e+00 | 1.838780390173156e-06 | 3.577393755200692e-01 | PASS |
| spack_foss-2023a_mpi_min | -2.020313234969951e+00 | 1.911869663473453e-06 | 3.719590784967808e-01 | PASS |
| spack_foss-2022a_cuda_serial | -2.020313229249438e+00 | 1.917590176425676e-06 | 3.730720187598592e-01 | PASS |
| spack_foss-2022a_mpi_min | -2.020313234969951e+00 | 1.911869663473453e-06 | 3.719590784967808e-01 | PASS |
| spack_foss-2023a_mpi_opt | -2.020313437740795e+00 | 1.709098819802080e-06 | 3.325094980159688e-01 | PASS |
| spack_foss-2023a_serial_omp | -2.020313227808285e+00 | 1.919031328956322e-06 | 3.733523986296347e-01 | PASS |
| spack_foss-2023a_serial_debug | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-01 | PASS |
| spack_foss-2022a_mpi | -2.020313270417581e+00 | 1.876422032864866e-06 | 3.650626523083397e-01 | PASS |
| spack_foss-2023a_mpi | -2.020313315519219e+00 | 1.831320395773162e-06 | 3.562880147418602e-01 | PASS |
| cmake_foss_2022a_full_mpi | -2.020313270028492e+00 | 1.876811122070166e-06 | 3.651383505973085e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -2.020313254450806e+00 | 1.892388808322210e-06 | 3.681690288564610e-01 | PASS |
| spack_foss-2023a_mpi_debug | -2.020313234461311e+00 | 1.912378303714490e-06 | 3.720580357421188e-01 | PASS |
| spack_foss-2023a_mpi_omp | -2.020313241757599e+00 | 1.905082015252191e-06 | 3.706385243681305e-01 | PASS |
| cmake_foss_2022a_min_serial | -2.020313218895844e+00 | 1.927943769963747e-06 | 3.750863365688223e-01 | PASS |
| cmake_foss_2022a_min_mpi | -2.020313249765547e+00 | 1.897074067169768e-06 | 3.690805578151301e-01 | PASS |
| spack_foss-2023b_serial | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-01 | PASS |
| spack_intel-2023a_serial | -2.020313528549583e+00 | 1.618290030869218e-06 | 3.148424184570464e-01 | PASS |
| spack_intel-2022a_serial_omp | -2.020313249433580e+00 | 1.897406034068183e-06 | 3.691451428148216e-01 | PASS |
| spack_intel-2023a_serial_omp | -2.020313285916060e+00 | 1.860923553920202e-06 | 3.620473840311677e-01 | PASS |
| spack_intel-2023a_impi | -2.020313242272689e+00 | 1.904566925503559e-06 | 3.705383123547780e-01 | PASS |
| spack_intel-2022a_impi_omp | -2.020313267995129e+00 | 1.878844485325715e-06 | 3.655339465614231e-01 | PASS |