Match comparison for Multipoles [step 0] (match type 12077)
Commits >
Commit e5fcdd4b6e483a88fb99eafb58d1df80750fbe8c >
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 | -1.208297101698546e-03 | 2.881440730823959e-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 |
| cmake_foss_2022a_full_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| 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 |
| cmake_foss_2022a_min_mpi | -1.207401148055467e-03 | 4.119480170754414e-06 | 8.014552861389911e-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 |
| cmake_foss_2022a_full_mpi | -1.207017828415397e-03 | 4.502799810825403e-06 | 8.760310916002730e-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 |
| eb_fosscuda-2022a | -1.206976782573269e-03 | 4.543845652953344e-06 | 8.840166639987050e-01 | PASS |
| intel-2022a_omp | -1.207259653582329e-03 | 4.260974643892574e-06 | 8.289833937534190e-01 | PASS |
| intel-2022b_impi | -1.207246565862741e-03 | 4.274062363481207e-06 | 8.315296427006240e-01 | PASS |
| intel-2022a_impi | -1.207210007152154e-03 | 4.310621074067817e-06 | 8.386422323089138e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -1.207177822487984e-03 | 4.342805738237693e-06 | 8.449038401240648e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.206951910577916e-03 | 4.568717648305515e-06 | 8.888555736002948e-01 | PASS |
| foss-2022a_mpi_omp | -1.207759616184467e-03 | 3.761012041754658e-06 | 7.317144050106339e-01 | PASS |
| eb_foss-2022b_libxc6 | -1.206845279751304e-03 | 4.675348474918401e-06 | 9.096008706066928e-01 | PASS |
| eb_foss-2022a | -1.207457089900721e-03 | 4.063538325501043e-06 | 7.905716586577904e-01 | PASS |
| eb_foss-2022a_debug | -1.207457089900721e-03 | 4.063538325501043e-06 | 7.905716586577904e-01 | PASS |
| intel-2022a_omp_impi | -1.206972848711782e-03 | 4.547779514439904e-06 | 8.847820067003704e-01 | PASS |
| eb_foss-2022a_mpi | -1.206919152140010e-03 | 4.601476086212248e-06 | 8.952288105471299e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -1.207123883923633e-03 | 4.396744302588790e-06 | 8.553977242390642e-01 | PASS |
| eb_foss-2022a_mpi_debug | -1.208974265267546e-03 | 2.546362958676324e-06 | 4.954013538280786e-01 | PASS |