Match comparison for Multipoles [step 0] (match type 12077)
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
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 | -1.208185784679991e-03 | 2.842529669631910e-06 | -1.211520628226222e-03 | 4.675348474918184e-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 |
| 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 | -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_mpi | -1.208001282955909e-03 | 3.519345270312996e-06 | 6.846975234071977e-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 |
| intel-2022a_omp | -1.207259653582329e-03 | 4.260974643892574e-06 | 8.289833937534190e-01 | PASS |
| intel-2022b_impi | -1.207180785455009e-03 | 4.339842771213182e-06 | 8.443273873955607e-01 | PASS |
| intel-2022a_impi | -1.207301169156294e-03 | 4.219459069927873e-06 | 8.209064338381075e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -1.207327675286571e-03 | 4.192952939651102e-06 | 8.157495991539108e-01 | PASS |
| eb_fosscuda-2022a | -1.206976782573269e-03 | 4.543845652953344e-06 | 8.840166639987050e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| foss-2022a_mpi_omp | -1.206984671547867e-03 | 4.535956678354764e-06 | 8.824818440378918e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.207190754328347e-03 | 4.329873897875253e-06 | 8.423879178745629e-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 | -1.207157061722711e-03 | 4.363566503511268e-06 | 8.489428995158110e-01 | PASS |
| eb_foss-2022a_mpi | -1.206930045740531e-03 | 4.590582485690603e-06 | 8.931094330137361e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -1.207032698000932e-03 | 4.487930225290310e-06 | 8.731381761265194e-01 | PASS |
| eb_foss-2022a_mpi_debug | -1.207036625626670e-03 | 4.484002599551779e-06 | 8.723740466054044e-01 | PASS |