Match comparison for By (x= 0,y= 0,z=3.02) [step 400] (match type 25759)
Commits >
Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 >
Input 12-tddft-currents-to-maxwell.03-benzene-mxll-td-veloc-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.955589798195430e-07 | 8.479999999999999e-12 | -2.955589798195374e-07 | 4.304120772259334e-21 | -2.955589798195360e-07 | 1.000557668944142e-20 | PASS |
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Detailed information
Reference: -0.000000295558979819543, precision: 0.00000000000848| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | -2.955589798195340e-07 | 8.999725064576941e-21 | 1.061288333086904e-09 | PASS |
| spack_foss-2022a_serial_opt | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| spack_foss-2022a_serial_min | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| spack_foss-2022a_serial | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| foss-2022a_opt | -2.955589798195410e-07 | 2.011703249728963e-21 | 2.372291568076608e-10 | PASS |
| intel-2022b | -2.955589798195320e-07 | 1.101142831430590e-20 | 1.298517489894564e-09 | PASS |
| intel-2022a | -2.955589798195320e-07 | 1.101142831430590e-20 | 1.298517489894564e-09 | PASS |
| spack_foss-2022a_serial_omp | -2.955589798195450e-07 | -2.011703249728963e-21 | -2.372291568076608e-10 | PASS |
| spack_foss-2022a_serial_debug | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| foss-2022a_omp | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| spack_foss-2022a_mpi | -2.955589798195340e-07 | 8.999725064576941e-21 | 1.061288333086904e-09 | PASS |
| intel-2022a_omp | -2.955589798195320e-07 | 1.101142831430590e-20 | 1.298517489894564e-09 | PASS |
| intel-2022a_impi | -2.955589798195360e-07 | 6.988021814847978e-21 | 8.240591762792428e-10 | PASS |
| cmake_foss_2022a_full_mpi | -2.955589798195340e-07 | 8.999725064576941e-21 | 1.061288333086904e-09 | PASS |
| spack_foss-2022a_mpi_omp | -2.955589798195460e-07 | -3.017554874593445e-21 | -3.558437352114912e-10 | PASS |
| eb_fosscuda-2022a | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| cmake_foss_2022a_full_serial | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| cmake_foss_2022a_min_serial | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| foss-2022a_mpi_omp | -2.955589798195410e-07 | 2.011703249728963e-21 | 2.372291568076608e-10 | PASS |
| cmake_foss_2022a_min_mpi | -2.955589798195450e-07 | -2.011703249728963e-21 | -2.372291568076608e-10 | PASS |
| eb_foss-2022a | -2.955589798195410e-07 | 2.011703249728963e-21 | 2.372291568076608e-10 | PASS |
| eb_foss-2022b_libxc6 | -2.955589798195340e-07 | 8.999725064576941e-21 | 1.061288333086904e-09 | PASS |
| intel-2022a_omp_impi | -2.955589798195260e-07 | 1.699359850428940e-20 | 2.003962087769977e-09 | PASS |
| eb_foss-2022a_debug | -2.955589798195410e-07 | 2.011703249728963e-21 | 2.372291568076608e-10 | PASS |
| eb_foss-2022a_mpi | -2.955589798195360e-07 | 6.988021814847978e-21 | 8.240591762792428e-10 | PASS |
| eb_foss-2022b_libxc6_mpi | -2.955589798195380e-07 | 5.029258124322408e-21 | 5.930728920191520e-10 | PASS |
| eb_foss-2022a_mpi_debug | -2.955589798195360e-07 | 6.988021814847978e-21 | 8.240591762792428e-10 | PASS |
| eb_fosscuda-2022a_mpi_omp | -2.955589798195420e-07 | 1.005851624864482e-21 | 1.186145784038304e-10 | PASS |
| intel-2022b_impi | -2.955589798195360e-07 | 6.988021814847978e-21 | 8.240591762792428e-10 | PASS |