Match comparison for Exchange energy (match type 1020)
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Input 28-carbon_big_box.01-ground_state.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.067869100000000e-01 | 1.000000000000000e-04 | -3.067801600000001e-01 | 1.110223024625157e-16 | -3.067801600000000e-01 | 0.000000000000000e+00 | PASS |
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Detailed information
Reference: -0.30678691, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_min_autotools: [foss2022a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_min_autotools: [foss2023a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_min_autotools: [foss2023b-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_autotools: [foss2022a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_autotools: [foss2023b-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| intel_autotools: [intel2023a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_autotools: [foss2023a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -3.067801600000000e-01 | 6.749999999999812e-06 | 6.749999999999812e-02 | PASS |