Match comparison for Multipoles [step 0] (match type 12073)
Commits >
Commit fa579c158b779976d5f0fa5d04f6d011c21f022f >
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 | -1.209102143045797e-03 | 3.794402561965287e-06 | -1.211561409373244e-03 | 4.634567327896355e-06 | PASS |
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Detailed information
Reference: -0.001211520628226222, precision: 0.00000514| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_min | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2022a_serial_min | -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-2022a_serial | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2023a_serial | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2023b_serial | -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-2022a_mpi_min | -1.206989655173463e-03 | 4.530973052759230e-06 | 8.815122670737802e-01 | PASS |
| spack_foss-2023a_mpi_min | -1.206989655173463e-03 | 4.530973052759230e-06 | 8.815122670737802e-01 | PASS |
| spack_foss-2023a_mpi_opt | -1.207027690913604e-03 | 4.492937312618401e-06 | 8.741123176300390e-01 | PASS |
| spack_foss-2023a_serial_debug | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2023a_serial_omp | -1.206973290279592e-03 | 4.547337946629810e-06 | 8.846960985661109e-01 | PASS |
| cmake_foss_2022a_full_mpi | -1.207207922836268e-03 | 4.312705389954369e-06 | 8.390477412362586e-01 | PASS |
| spack_foss-2022a_mpi | -1.206926842045347e-03 | 4.593786180874743e-06 | 8.937327200145414e-01 | PASS |
| spack_foss-2023a_mpi | -1.207276978839475e-03 | 4.243649386746979e-06 | 8.256127211569997e-01 | PASS |
| spack_foss-2023a_mpi_debug | -1.207001867276278e-03 | 4.518760949944129e-06 | 8.791363715844609e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -1.207081527177564e-03 | 4.439101048657685e-06 | 8.636383363147246e-01 | PASS |
| spack_foss-2023a_mpi_omp | -1.207124555090186e-03 | 4.396073136035900e-06 | 8.552671470886964e-01 | PASS |
| spack_foss-2022a_cuda_serial | -1.206976685432098e-03 | 4.543942794123451e-06 | 8.840355630590373e-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 | -1.207093185420227e-03 | 4.427442805994769e-06 | 8.613701957188268e-01 | PASS |
| spack_intel-2023a_serial | -1.207662999873849e-03 | 3.857628352373294e-06 | 7.505113526018081e-01 | PASS |
| spack_intel-2022a_serial_omp | -1.207023383647005e-03 | 4.497244579217347e-06 | 8.749503072407290e-01 | PASS |
| spack_intel-2023a_serial_omp | -1.207108607710075e-03 | 4.412020516146803e-06 | 8.583697502231135e-01 | PASS |
| spack_intel-2023a_impi | -1.207075273954861e-03 | 4.445354271361219e-06 | 8.648549166072410e-01 | PASS |
| spack_intel-2022a_impi_omp | -1.207025088019328e-03 | 4.495540206893517e-06 | 8.746187172944586e-01 | PASS |