Match comparison for External energy (match type 12951)
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Input 03-sodium_chain.01-ground_state.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 8.030990720000000e+00 | 4.020000000000000e-07 | 8.030990625666668e+00 | 4.681049232026486e-08 | 8.030990665000001e+00 | 6.499999916087518e-08 | PASS |
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Detailed information
Reference: 8.03099072, precision: 0.000000402| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_autotools: [foss2022a-serial] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_autotools: [foss2023b-serial] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| intel_autotools: [intel2023a-serial] | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| foss_autotools: [foss2023a-serial] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 8.030990610000000e+00 | -1.100000002196566e-07 | -2.736318413424293e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 8.030990720000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 8.030990720000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 8.030990700000000e+00 | -1.999999987845058e-08 | -4.975124347873278e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 8.030990600000001e+00 | -1.199999992707035e-07 | -2.985074608723967e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 8.030990729999999e+00 | 9.999999051046871e-09 | 2.487561952996734e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 8.030990610000000e+00 | -1.100000002196566e-07 | -2.736318413424293e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 8.030990720000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 8.030990720000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |