Match comparison for Multipoles [step 0] (match type 12077)
Commits >
Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 >
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 | -1.208067980596977e-03 | 2.766448221764925e-06 | -1.211520628226222e-03 | 4.675348474918184e-06 | PASS |
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Detailed information
Reference: -0.001211520628226222, precision: 0.00000514| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | -1.206999593605332e-03 | 4.521034620890091e-06 | 8.795787200175275e-01 | PASS |
| spack_foss-2022a_serial_opt | -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-2022a_serial | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| foss-2022a_opt | -1.207279040895154e-03 | 4.241587331067992e-06 | 8.252115430093371e-01 | PASS |
| intel-2022b | -1.207506651185838e-03 | 4.013977040383471e-06 | 7.809293852886131e-01 | PASS |
| intel-2022a | -1.207506651185838e-03 | 4.013977040383471e-06 | 7.809293852886131e-01 | PASS |
| spack_foss-2022a_serial_omp | -1.207017478341954e-03 | 4.503149884267860e-06 | 8.760991992739028e-01 | PASS |
| spack_foss-2022a_serial_debug | -1.216195976701140e-03 | -4.675348474917967e-06 | -9.096008706066084e-01 | PASS |
| foss-2022a_omp | -1.207124443779295e-03 | 4.396184446926960e-06 | 8.552888029040778e-01 | PASS |
| spack_foss-2022a_mpi | -1.207168209259493e-03 | 4.352418966728716e-06 | 8.467741180406063e-01 | PASS |
| intel-2022a_omp | -1.207259653582329e-03 | 4.260974643892574e-06 | 8.289833937534190e-01 | PASS |
| intel-2022a_impi | -1.207095319690030e-03 | 4.425308536192213e-06 | 8.609549681307808e-01 | PASS |
| cmake_foss_2022a_full_mpi | -1.207106547690198e-03 | 4.414080536023707e-06 | 8.587705323003322e-01 | PASS |
| spack_foss-2022a_mpi_omp | -1.206959270261931e-03 | 4.561357964290519e-06 | 8.874237284611906e-01 | PASS |
| eb_fosscuda-2022a | -1.206976782573269e-03 | 4.543845652953344e-06 | 8.840166639987050e-01 | PASS |
| cmake_foss_2022a_full_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| foss-2022a_mpi_omp | -1.207034765750195e-03 | 4.485862476026831e-06 | 8.727358902775936e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.207043304233463e-03 | 4.477323992759180e-06 | 8.710747067624864e-01 | PASS |
| eb_foss-2022a | -1.207457089900721e-03 | 4.063538325501043e-06 | 7.905716586577904e-01 | PASS |
| eb_foss-2022b_libxc6 | -1.206845279751304e-03 | 4.675348474918401e-06 | 9.096008706066928e-01 | PASS |
| intel-2022a_omp_impi | -1.207017239265862e-03 | 4.503388960360117e-06 | 8.761457121323184e-01 | PASS |
| eb_foss-2022a_debug | -1.207457089900721e-03 | 4.063538325501043e-06 | 7.905716586577904e-01 | PASS |
| eb_foss-2022a_mpi | -1.207029816055250e-03 | 4.490812170972408e-06 | 8.736988659479394e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -1.207000603131198e-03 | 4.520025095024411e-06 | 8.793823142070838e-01 | PASS |
| eb_foss-2022a_mpi_debug | -1.207251239624785e-03 | 4.269388601437158e-06 | 8.306203504741552e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -1.207243416734935e-03 | 4.277211491286953e-06 | 8.321423134799520e-01 | PASS |
| intel-2022b_impi | -1.207148289076088e-03 | 4.372339150134292e-06 | 8.506496401039478e-01 | PASS |