Match comparison for Benzene Multipoles [step 20] (match type 20993)
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
Input 12-tddft-currents-to-maxwell.05-benzene-extsource-td-veloc-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 9.520492016833351e-04 | 1.000000000000000e-07 | 9.520492016810628e-04 | 7.660441520663393e-15 | 9.520492016815937e-04 | 1.304235582380575e-14 | PASS |
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Detailed information
Reference: 0.0009520492016833351, precision: 0.0000001| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | 9.520492016836505e-04 | 3.153944119760332e-16 | 3.153944119760332e-09 | PASS |
| spack_foss-2022a_serial_min | 9.520492016836505e-04 | 3.153944119760332e-16 | 3.153944119760332e-09 | PASS |
| foss-2022a_ppc | 9.520492016689671e-04 | -1.436806403021240e-14 | -1.436806403021240e-07 | PASS |
| spack_foss-2022a_serial_opt | 9.520492016836505e-04 | 3.153944119760332e-16 | 3.153944119760332e-09 | PASS |
| spack_foss-2022a_serial | 9.520492016836505e-04 | 3.153944119760332e-16 | 3.153944119760332e-09 | PASS |
| foss-2022a_opt | 9.520492016866890e-04 | 3.353871000366659e-15 | 3.353871000366659e-08 | PASS |
| intel-2022b | 9.520492016713276e-04 | -1.200753906027696e-14 | -1.200753906027696e-07 | PASS |
| intel-2022a | 9.520492016713276e-04 | -1.200753906027696e-14 | -1.200753906027696e-07 | PASS |
| spack_foss-2022a_serial_omp | 9.520492016946361e-04 | 1.130096450446816e-14 | 1.130096450446816e-07 | PASS |
| cmake_foss_2022a_full_mpi | 9.520492016797202e-04 | -3.614946883501169e-15 | -3.614946883501169e-08 | PASS |
| spack_foss-2022a_serial_debug | 9.520492016836505e-04 | 3.153944119760332e-16 | 3.153944119760332e-09 | PASS |
| foss-2022a_omp | 9.520492016820493e-04 | -1.285863776567808e-15 | -1.285863776567808e-08 | PASS |
| intel-2022a_omp | 9.520492016695583e-04 | -1.377684858555606e-14 | -1.377684858555606e-07 | PASS |
| intel-2022b_impi | 9.520492016706809e-04 | -1.265426565616457e-14 | -1.265426565616457e-07 | PASS |
| intel-2022a_impi | 9.520492016706809e-04 | -1.265426565616457e-14 | -1.265426565616457e-07 | PASS |
| eb_fosscuda-2022a_mpi_omp | 9.520492016802032e-04 | -3.131934815658877e-15 | -3.131934815658877e-08 | PASS |
| eb_fosscuda-2022a | 9.520492016775838e-04 | -5.751367264383855e-15 | -5.751367264383855e-08 | PASS |
| cmake_foss_2022a_min_serial | 9.520492016836505e-04 | 3.153944119760332e-16 | 3.153944119760332e-09 | PASS |
| foss-2022a_mpi_omp | 9.520492016788367e-04 | -4.498463233859606e-15 | -4.498463233859606e-08 | PASS |
| cmake_foss_2022a_min_mpi | 9.520492016933422e-04 | 1.000707763182396e-14 | 1.000707763182396e-07 | PASS |
| eb_foss-2022a | 9.520492016866890e-04 | 3.353871000366659e-15 | 3.353871000366659e-08 | PASS |
| eb_foss-2022b_libxc6 | 9.520492016802240e-04 | -3.111118133947155e-15 | -3.111118133947155e-08 | PASS |
| eb_foss-2022a_debug | 9.520492016866890e-04 | 3.353871000366659e-15 | 3.353871000366659e-08 | PASS |
| intel-2022a_omp_impi | 9.520492016685514e-04 | -1.478374714314334e-14 | -1.478374714314334e-07 | PASS |
| eb_foss-2022a_mpi | 9.520492016874400e-04 | 4.104897845247368e-15 | 4.104897845247368e-08 | PASS |
| eb_foss-2022b_libxc6_mpi | 9.520492016941523e-04 | 1.081719349510513e-14 | 1.081719349510513e-07 | PASS |
| eb_foss-2022a_mpi_debug | 9.520492016874400e-04 | 4.104897845247368e-15 | 4.104897845247368e-08 | PASS |