Match comparison for Multipoles [step 20] (match type 12074)
Commits >
Commit b15abc005d0b5301cd748c91bbd98ee634ebaa25 >
Input 14-fullerene_unpacked.02-td-unpacked.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.020315146839614e+00 | 5.140000000000000e-06 | -2.020314150439025e+00 | 1.595071979393014e-06 | -2.020315170040013e+00 | 1.951144168899077e-06 | PASS |
Checks do not indicate problems with this match.
Loading plot...
Detailed information
Reference: -2.0203151468396143, precision: 0.00000514| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_opt | -2.020313218895844e+00 | 1.927943769963747e-06 | 3.750863365688223e-01 | PASS |
| spack_foss-2023a_serial | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-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_foss-2022a_ppc | -2.020313308059224e+00 | 1.838780390173156e-06 | 3.577393755200692e-01 | PASS |
| cmake_foss_2022a_full_mpi | -2.020313330156975e+00 | 1.816682638988709e-06 | 3.534402021378812e-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 | -2.020313249083060e+00 | 1.897756554569696e-06 | 3.692133374649215e-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_foss-2022a_cuda_serial | -2.020313229249438e+00 | 1.917590176425676e-06 | 3.730720187598592e-01 | PASS |
| spack_intel-2023a_impi | -2.020313272704064e+00 | 1.874135550750111e-06 | 3.646178114299827e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -2.020313267860742e+00 | 1.878978872049686e-06 | 3.655600918384603e-01 | PASS |
| spack_foss-2023a_mpi_omp | -2.020313223480758e+00 | 1.923358856181778e-06 | 3.741943299964549e-01 | PASS |
| cmake_foss_2022a_min_serial | -2.020313218895844e+00 | 1.927943769963747e-06 | 3.750863365688223e-01 | PASS |
| cmake_foss_2022a_min_mpi | -2.020313241115380e+00 | 1.905724234418926e-06 | 3.707634697313086e-01 | PASS |
| spack_foss-2022a_serial_min | -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-2022a_mpi_min | -2.020313234969951e+00 | 1.911869663473453e-06 | 3.719590784967808e-01 | PASS |
| spack_foss-2022a_mpi | -2.020313222901069e+00 | 1.923938545367321e-06 | 3.743071099936422e-01 | PASS |
| spack_intel-2022a_impi_omp | -2.020313241398469e+00 | 1.905441145755304e-06 | 3.707083941158180e-01 | PASS |
| spack_foss-2023a_mpi | -2.020313326344129e+00 | 1.820495485027607e-06 | 3.541820009781336e-01 | PASS |
| spack_foss-2023a_mpi_debug | -2.020314004060330e+00 | 1.142779284535322e-06 | 2.223306001041483e-01 | PASS |
| cmake_foss_2022a_full_serial | -2.020313218895844e+00 | 1.927943769963747e-06 | 3.750863365688223e-01 | PASS |
| spack_foss-2023a_serial_min | -2.020317121184182e+00 | -1.974344567834407e-06 | -3.841137291506629e-01 | PASS |