Match comparison for Multipoles [step 0] (match type 12073)
Commits >
Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 >
Input 14-fullerene_unpacked.02-td-unpacked.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.211520628226222e-03 | 5.140000000000000e-06 | -1.209131064770048e-03 | 3.780933217232614e-06 | -1.211559816390949e-03 | 4.636160310191040e-06 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -0.001211520628226222, precision: 0.00000514| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2023a_serial_min | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2022a_ppc | -1.207161061433260e-03 | 4.359566792962394e-06 | 8.481647457125281e-01 | PASS |
| spack_foss-2023a_serial | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2022a_serial | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2023a_serial_opt | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| spack_foss-2023b_serial | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2023a_mpi_min | -1.206989655173463e-03 | 4.530973052759230e-06 | 8.815122670737802e-01 | PASS |
| spack_foss-2023a_serial_omp | -1.206973290279592e-03 | 4.547337946629810e-06 | 8.846960985661109e-01 | PASS |
| spack_intel-2022a_serial_omp | -1.207023383647005e-03 | 4.497244579217347e-06 | 8.749503072407290e-01 | PASS |
| spack_foss-2023a_mpi_opt | -1.207031754629787e-03 | 4.488873596435400e-06 | 8.733217113687549e-01 | PASS |
| spack_foss-2023a_serial_debug | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2023a_mpi | -1.207321171442968e-03 | 4.199456783253669e-06 | 8.170149383762002e-01 | PASS |
| cmake_foss_2022a_full_mpi | -1.206997396866971e-03 | 4.523231359250751e-06 | 8.800061010215470e-01 | PASS |
| spack_foss-2023a_mpi_debug | -1.207144364969534e-03 | 4.376263256687879e-06 | 8.514130849587314e-01 | PASS |
| spack_foss-2022a_cuda_serial | -1.206976685432098e-03 | 4.543942794123451e-06 | 8.840355630590373e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -1.207633388459875e-03 | 3.887239766346912e-06 | 7.562723280830568e-01 | PASS |
| spack_foss-2023a_mpi_omp | -1.206923656080758e-03 | 4.596972145464112e-06 | 8.943525574832903e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| cmake_foss_2022a_full_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.207253450797668e-03 | 4.267177428553476e-06 | 8.301901611971744e-01 | PASS |
| spack_intel-2023a_serial | -1.207662999873849e-03 | 3.857628352373294e-06 | 7.505113526018081e-01 | PASS |
| spack_foss-2022a_mpi_min | -1.206989655173463e-03 | 4.530973052759230e-06 | 8.815122670737802e-01 | PASS |
| spack_intel-2022a_impi_omp | -1.207339946378991e-03 | 4.180681847231133e-06 | 8.133622270877691e-01 | PASS |
| spack_foss-2022a_mpi | -1.206958036271452e-03 | 4.562591954769763e-06 | 8.876638044299150e-01 | PASS |
| spack_intel-2023a_serial_omp | -1.207108607710075e-03 | 4.412020516146803e-06 | 8.583697502231135e-01 | PASS |
| spack_intel-2023a_impi | -1.207018652229913e-03 | 4.501975996308799e-06 | 8.758708164024902e-01 | PASS |