Match comparison for Benzene Multipoles [step 20] (match type 30137)
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Input 12-tddft-currents-to-maxwell.03-benzene-mxll-td-veloc-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.094497201627904e-02 | 1.670000000000000e-14 | -2.094497201627287e-02 | 7.080545636390667e-15 | -2.094497201627913e-02 | 1.511638036966190e-14 | PASS |
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Detailed information
Reference: -0.02094497201627904, precision: 0.0000000000000167| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -2.094497201628125e-02 | -2.206568261442499e-15 | -1.321298360145209e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -2.094497201628149e-02 | -2.452898995031205e-15 | -1.468801793431859e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -2.094497201627576e-02 | 3.282096816548119e-15 | 1.965327435058754e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -2.094497201627141e-02 | 7.629313847345998e-15 | 4.568451405596405e-01 | PASS |
| foss-ppc: [foss2022a-serial] | -2.094497201627390e-02 | 5.138250935843303e-15 | 3.076796967570840e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -2.094497201627826e-02 | 7.840950111415168e-16 | 4.695179707434232e-02 | PASS |
| foss-serial-min: [foss2022a-serial] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -2.094497201627826e-02 | 7.840950111415168e-16 | 4.695179707434232e-02 | PASS |
| foss-serial-full: [foss2023a-serial] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -2.094497201628722e-02 | -8.184425359658576e-15 | -4.900853508777590e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -2.094497201626401e-02 | 1.502617474891110e-14 | 8.997709430485690e-01 | PASS |
| intel-serial: [intel2023a-serial] | -2.094497201628441e-02 | -5.374173328576148e-15 | -3.218067861422843e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -2.094497201626686e-02 | 1.218122824830914e-14 | 7.294148651682119e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -2.094497201627422e-02 | 4.822531263215524e-15 | 2.887743271386541e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -2.094497201627422e-02 | 4.822531263215524e-15 | 2.887743271386541e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -2.094497201627422e-02 | 4.822531263215524e-15 | 2.887743271386541e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -2.094497201627422e-02 | 4.822531263215524e-15 | 2.887743271386541e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -2.094497201626636e-02 | 1.267735916243851e-14 | 7.591233031400303e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -2.094497201626636e-02 | 1.267735916243851e-14 | 7.591233031400303e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -2.094497201627422e-02 | 4.822531263215524e-15 | 2.887743271386541e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -2.094497201626636e-02 | 1.267735916243851e-14 | 7.591233031400303e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -2.094497201626636e-02 | 1.267735916243851e-14 | 7.591233031400303e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -2.094497201629425e-02 | -1.520658599041269e-14 | -9.105740114019575e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -2.094497201627607e-02 | 2.966377143920340e-15 | 1.776273738874455e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -2.094497201627329e-02 | 5.745404152435185e-15 | 3.440361767925260e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -2.094497201627405e-02 | 4.989064716909297e-15 | 2.987463902340897e-01 | PASS |