Match comparison for Diamagnetic current (x=-0.38, y= 0,z=0) [step 20] (match type 23480)
Commits >
Commit dfb998a08bfe04488932b5e2d20d2b9995cc9a79 >
Input 12-tddft-currents-to-maxwell.04-benzene-mxll-td-full-min-coup.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 9.629216431984570e-09 | 2.000000000000000e-10 | 9.629216431984393e-09 | 1.543368938866268e-21 | 9.629216431984190e-09 | 3.530406854376322e-21 | PASS |
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Detailed information
Reference: 0.00000000962921643198457, precision: 0.0000000002| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | 9.629216431980660e-09 | -3.910909936150715e-21 | -1.955454968075357e-11 | PASS |
| cmake_foss_2022a_full_serial | 9.629216431983520e-09 | -1.050519377942345e-21 | -5.252596889711726e-12 | PASS |
| foss-2022a_opt | 9.629216431984870e-09 | 2.994393817441960e-22 | 1.497196908720980e-12 | PASS |
| intel-2022a | 9.629216431986470e-09 | 1.899206686421752e-21 | 9.496033432108758e-12 | PASS |
| cmake_foss_2022a_full_mpi | 9.629216431984489e-09 | -8.106370003019671e-23 | -4.053185001509836e-13 | PASS |
| cmake_foss_2022a_min_serial | 9.629216431983520e-09 | -1.050519377942345e-21 | -5.252596889711726e-12 | PASS |
| foss-2022a_omp | 9.629216431985960e-09 | 1.389663429089086e-21 | 6.948317145445432e-12 | PASS |
| cmake_foss_2022a_min_mpi | 9.629216431983060e-09 | -1.510431798521829e-21 | -7.552158992609143e-12 | PASS |
| eb_fosscuda-2022a | 9.629216431984551e-09 | -1.985233470127266e-23 | -9.926167350636332e-14 | PASS |
| intel-2022a_impi | 9.629216431983110e-09 | -1.460800961768647e-21 | -7.304004808843234e-12 | PASS |
| eb_foss-2022a | 9.629216431984870e-09 | 2.994393817441960e-22 | 1.497196908720980e-12 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 9.629216431985580e-09 | 1.009160347314694e-21 | 5.045801736573469e-12 | PASS |
| eb_foss-2022a_debug | 9.629216431984870e-09 | 2.994393817441960e-22 | 1.497196908720980e-12 | PASS |
| eb_foss-2022b_libxc6 | 9.629216431985881e-09 | 1.310254090283996e-21 | 6.551270451419979e-12 | PASS |
| eb_foss-2022a_mpi | 9.629216431984670e-09 | 9.926167350636332e-23 | 4.963083675318166e-13 | PASS |
| foss-2022a_mpi_omp | 9.629216431984660e-09 | 8.933550615572699e-23 | 4.466775307786349e-13 | PASS |
| eb_foss-2022b_libxc6_mpi | 9.629216431986820e-09 | 2.249931266144235e-21 | 1.124965633072118e-11 | PASS |
| intel-2022b | 9.629216431986470e-09 | 1.899206686421752e-21 | 9.496033432108758e-12 | PASS |
| eb_foss-2022a_mpi_debug | 9.629216431984670e-09 | 9.926167350636332e-23 | 4.963083675318166e-13 | PASS |
| spack_foss-2022a_serial | 9.629216431983520e-09 | -1.050519377942345e-21 | -5.252596889711726e-12 | PASS |
| intel-2022a_omp | 9.629216431984430e-09 | -1.406207041340147e-22 | -7.031035206700735e-13 | PASS |
| spack_foss-2022a_mpi | 9.629216431984489e-09 | -8.106370003019671e-23 | -4.053185001509836e-13 | PASS |
| spack_foss-2022a_serial_debug | 9.629216431983520e-09 | -1.050519377942345e-21 | -5.252596889711726e-12 | PASS |
| spack_foss-2022a_serial_min | 9.629216431983520e-09 | -1.050519377942345e-21 | -5.252596889711726e-12 | PASS |
| intel-2022b_impi | 9.629216431983110e-09 | -1.460800961768647e-21 | -7.304004808843234e-12 | PASS |
| spack_foss-2022a_serial_omp | 9.629216431984059e-09 | -5.111976185577711e-22 | -2.555988092788856e-12 | PASS |
| spack_foss-2022a_serial_opt | 9.629216431983520e-09 | -1.050519377942345e-21 | -5.252596889711726e-12 | PASS |
| spack_foss-2022a_mpi_omp | 9.629216431980820e-09 | -3.750436897315427e-21 | -1.875218448657714e-11 | PASS |
| intel-2022a_omp_impi | 9.629216431987720e-09 | 3.149903772601929e-21 | 1.574951886300965e-11 | PASS |