Match comparison for Multipoles [step 20] (match type 12078)
Commits >
Commit 7ddcca10159cfd3a5f031627bc95daf6cfe3e221 >
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 | -2.020314279330323e+00 | 1.689383995317714e-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-2022a_serial_min | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-01 | PASS |
| spack_foss-2023a_serial_min | -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_serial | -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-2023b_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-2022a_mpi_min | -2.020313234969951e+00 | 1.911869663473453e-06 | 3.719590784967808e-01 | PASS |
| spack_foss-2023a_mpi_min | -2.020313234969951e+00 | 1.911869663473453e-06 | 3.719590784967808e-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-2023a_mpi_opt | -2.020313239912901e+00 | 1.906926712980095e-06 | 3.709974149766722e-01 | PASS |
| spack_foss-2022a_mpi | -2.020313257779804e+00 | 1.889059810800120e-06 | 3.675213639688950e-01 | PASS |
| spack_foss-2023a_mpi | -2.020313316998161e+00 | 1.829841453471204e-06 | 3.560002827764988e-01 | PASS |
| spack_foss-2022a_cuda_serial | -2.020313229249438e+00 | 1.917590176425676e-06 | 3.730720187598592e-01 | PASS |
| spack_foss-2023a_mpi_debug | -2.020313247336071e+00 | 1.899503542901471e-06 | 3.695532184633211e-01 | PASS |
| spack_foss-2023a_mpi_omp | -2.020313269551458e+00 | 1.877288156038048e-06 | 3.652311587622662e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -2.020313247266252e+00 | 1.899573362607043e-06 | 3.695668020636271e-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-2022a_impi_omp | -2.020313312199957e+00 | 1.834639657083414e-06 | 3.569337854247888e-01 | PASS |
| spack_intel-2023a_impi | -2.020313288595804e+00 | 1.858243810382021e-06 | 3.615260331482531e-01 | PASS |