Match comparison for Multipoles [step 0] (match type 12077)
Commits >
Commit b2c9b4a951ad3e3faeb99c2d543d652f634c0371 >
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 | -1.208194922813326e-03 | 2.895248755026692e-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_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 |
| cmake_foss_2022a_full_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-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 |
| cmake_foss_2022a_full_mpi | -1.207203955640473e-03 | 4.316672585748466e-06 | 8.398195692117638e-01 | PASS |
| intel-2022a_omp | -1.207259653582329e-03 | 4.260974643892574e-06 | 8.289833937534190e-01 | PASS |
| intel-2022b_impi | -1.207279885546031e-03 | 4.240742680190973e-06 | 8.250472140449365e-01 | PASS |
| intel-2022a_impi | -1.207071678829122e-03 | 4.448949397099994e-06 | 8.655543574124502e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.207042048164797e-03 | 4.478580061424925e-06 | 8.713190780982345e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| foss-2022a_mpi_omp | -1.207070829981866e-03 | 4.449798244356368e-06 | 8.657195027930678e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -1.207130697238226e-03 | 4.389930987995722e-06 | 8.540721766528642e-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 |
| eb_foss-2022a_debug | -1.207457089900721e-03 | 4.063538325501043e-06 | 7.905716586577904e-01 | PASS |
| intel-2022a_omp_impi | -1.207011658996435e-03 | 4.508969229787213e-06 | 8.772313676628820e-01 | PASS |
| eb_foss-2022a_mpi | -1.207312653162707e-03 | 4.207975063515385e-06 | 8.186721913454056e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -1.206984462629887e-03 | 4.536165596334902e-06 | 8.825224895593193e-01 | PASS |
| eb_foss-2022a_mpi_debug | -1.207038616995934e-03 | 4.482011230287847e-06 | 8.719866206785695e-01 | PASS |
| eb_fosscuda-2022a | -1.206976782573269e-03 | 4.543845652953344e-06 | 8.840166639987050e-01 | PASS |