Match comparison for Benzene Multipoles [step 20] (match type 20993)
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Input 12-tddft-currents-to-maxwell.05-benzene-extsource-td-veloc-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -9.520492016606303e-04 | 1.000000000000000e-07 | -9.520492016714409e-04 | 7.773425425914297e-15 | -9.520492016707092e-04 | 1.376161554503263e-14 | PASS |
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Detailed information
Reference: -0.0009520492016606303, precision: 0.0000001| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_ppc | -9.520492016823660e-04 | -2.173565147312040e-14 | -2.173565147312040e-07 | PASS |
| cmake_foss_2022a_full_serial | -9.520492016675306e-04 | -6.900296306566744e-15 | -6.900296306566744e-08 | PASS |
| cmake_foss_2022a_min_serial | -9.520492016675306e-04 | -6.900296306566744e-15 | -6.900296306566744e-08 | PASS |
| cmake_foss_2022a_full_mpi | -9.520492016722809e-04 | -1.165061970509473e-14 | -1.165061970509473e-07 | PASS |
| eb_fosscuda-2022a | -9.520492016744698e-04 | -1.383951547112572e-14 | -1.383951547112572e-07 | PASS |
| cmake_foss_2022a_min_mpi | -9.520492016590135e-04 | 1.616762279610384e-15 | 1.616762279610384e-08 | PASS |
| eb_foss-2022a_debug | -9.520492016668317e-04 | -6.201419586182588e-15 | -6.201419586182588e-08 | PASS |
| eb_foss-2022b_libxc6 | -9.520492016730954e-04 | -1.246507237706584e-14 | -1.246507237706584e-07 | PASS |
| eb_intel-2022a | -9.520492016811558e-04 | -2.052546500819208e-14 | -2.052546500819208e-07 | PASS |
| eb_foss-2022b_libxc6_mpi | -9.520492016606099e-04 | 2.038300084272748e-17 | 2.038300084272748e-10 | PASS |
| intel-2022b | -9.520492016811558e-04 | -2.052546500819208e-14 | -2.052546500819208e-07 | PASS |
| eb_intel-2022a_omp | -9.520492016844707e-04 | -2.384041315056651e-14 | -2.384041315056651e-07 | PASS |
| eb_foss-2022a_mpi_debug | -9.520492016651753e-04 | -4.544975507059235e-15 | -4.544975507059235e-08 | PASS |
| eb_intel-2022a_impi | -9.520492016810715e-04 | -2.044122249938995e-14 | -2.044122249938995e-07 | PASS |
| spack_foss-2022a_serial | -9.520492016675306e-04 | -6.900296306566744e-15 | -6.900296306566744e-08 | PASS |
| spack_foss-2022a_mpi | -9.520492016722809e-04 | -1.165061970509473e-14 | -1.165061970509473e-07 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -9.520492016659861e-04 | -5.355741891643895e-15 | -5.355741891643895e-08 | PASS |
| spack_foss-2022a_serial_min | -9.520492016675306e-04 | -6.900296306566744e-15 | -6.900296306566744e-08 | PASS |
| intel-2022b_impi | -9.520492016810715e-04 | -2.044122249938995e-14 | -2.044122249938995e-07 | PASS |
| spack_foss-2022a_serial_debug | -9.520492016675306e-04 | -6.900296306566744e-15 | -6.900296306566744e-08 | PASS |
| spack_foss-2022a_serial_omp | -9.520492016569475e-04 | 3.682817939498761e-15 | 3.682817939498761e-08 | PASS |
| spack_foss-2022a_serial_opt | -9.520492016675306e-04 | -6.900296306566744e-15 | -6.900296306566744e-08 | PASS |
| spack_foss-2022a_mpi_omp | -9.520492016696542e-04 | -9.023923101814102e-15 | -9.023923101814102e-08 | PASS |
| eb_intel-2022a_omp_impi | -9.520492016817615e-04 | -2.113120876195973e-14 | -2.113120876195973e-07 | PASS |