Match comparison for Ion-ion energy (match type 31081)
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Input 08-symmetrization_mgga.01-spg3_sym.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -5.328298460000001e+00 | 2.660000000000000e-07 | -5.328298460000003e+00 | 2.664535259100376e-15 | -5.328298460000000e+00 | 0.000000000000000e+00 | PASS |
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Detailed information
Reference: -5.328298460000001, precision: 0.000000266| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2022a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_min_autotools: [foss2023a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_min_autotools: [foss2023b-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_autotools: [foss2022a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_autotools: [foss2023a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| intel_autotools: [intel2023a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_autotools: [foss2023b-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -5.328298460000000e+00 | 8.881784197001252e-16 | 3.339016615414004e-09 | PASS |