Match comparison for Multipoles [step 0] (match type 12077)
Commits >
Commit 15b914f6cf8a906b04634cf1151edac44a3f54fa >
Input 14-fullerene_unpacked.03-td-packed.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.211520628226222e-03 | 5.140000000000000e-06 | -1.209107526638265e-03 | 3.791481174571054e-06 | -1.211573943639528e-03 | 4.622033061611741e-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 |
| cmake_foss_2022a_full_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| 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-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-2022a_ppc | -1.207161061433260e-03 | 4.359566792962394e-06 | 8.481647457125281e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.207005655331328e-03 | 4.514972894893938e-06 | 8.783993958937621e-01 | PASS |
| spack_foss-2023a_mpi_min | -1.206989655173463e-03 | 4.530973052759230e-06 | 8.815122670737802e-01 | PASS |
| spack_foss-2022a_mpi_min | -1.206989655173463e-03 | 4.530973052759230e-06 | 8.815122670737802e-01 | PASS |
| cmake_foss_2022a_full_mpi | -1.207218714187455e-03 | 4.301914038766725e-06 | 8.369482565694017e-01 | PASS |
| spack_foss-2023a_serial_debug | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| spack_foss-2023a_mpi_opt | -1.206980281037218e-03 | 4.540347189004252e-06 | 8.833360289891540e-01 | PASS |
| spack_foss-2022a_mpi | -1.207152145343421e-03 | 4.368482882801056e-06 | 8.498993935410615e-01 | PASS |
| spack_foss-2023a_mpi | -1.207087934949336e-03 | 4.432693276886163e-06 | 8.623916881101484e-01 | PASS |
| spack_foss-2022a_cuda_serial | -1.206976685432098e-03 | 4.543942794123451e-06 | 8.840355630590373e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -1.207124350218039e-03 | 4.396278008182925e-06 | 8.553070054830593e-01 | PASS |
| spack_foss-2023a_mpi_debug | -1.207235277975088e-03 | 4.285350251133574e-06 | 8.337257297925242e-01 | PASS |
| spack_foss-2023a_mpi_omp | -1.207162607673104e-03 | 4.358020553117898e-06 | 8.478639208400579e-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_serial_omp | -1.206973290279592e-03 | 4.547337946629810e-06 | 8.846960985661109e-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 | -1.207000256248217e-03 | 4.520371978005084e-06 | 8.794498011683042e-01 | PASS |
| spack_intel-2022a_impi_omp | -1.207019065606552e-03 | 4.501562619670324e-06 | 8.757903929319697e-01 | PASS |