Match comparison for Exchange energy (match type 12968)
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Input 03-sodium_chain.03-ground_state_disp.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.359242440000000e+00 | 1.180000000000000e-07 | -2.359242431666666e+00 | 4.533823475357644e-09 | -2.359242440000000e+00 | 9.999999939225290e-09 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -2.35924244, precision: 0.000000118| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_min_autotools: [foss2023a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_min_autotools: [foss2023b-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_min_autotools: [foss2022a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_autotools: [foss2023a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_autotools: [foss2023b-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_autotools: [foss2022a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| intel_autotools: [intel2023a-serial] | -2.359242440000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -2.359242440000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -2.359242440000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -2.359242450000000e+00 | -9.999999939225290e-09 | -8.474576219682449e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -2.359242430000000e+00 | 9.999999939225290e-09 | 8.474576219682449e-02 | PASS |