Match comparison for Total energy (match type 28345)
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Input 09-basis_from_states.03-intersite.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -4.175812929000000e+01 | 2.090000000000000e-07 | -4.175812927633332e+01 | 1.779200931501422e-08 | -4.175812929000000e+01 | 3.999999975690116e-08 | PASS |
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Detailed information
Reference: -41.75812929, precision: 0.000000209| Run | Value | Difference | Relative difference | Status |
| foss_opt_autotools: [foss2023a-serial] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -4.175812925000000e+01 | 3.999999620418748e-08 | 1.913875416468301e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -4.175812927000000e+01 | 2.000000165480742e-08 | 9.569378782204507e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -4.175812927000000e+01 | 2.000000165480742e-08 | 9.569378782204507e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -4.175812927000000e+01 | 2.000000165480742e-08 | 9.569378782204507e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -4.175812927000000e+01 | 2.000000165480742e-08 | 9.569378782204507e-02 | PASS |
| foss_autotools: [foss2023a-serial] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -4.175812931000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -4.175812927000000e+01 | 2.000000165480742e-08 | 9.569378782204507e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -4.175812926000000e+01 | 3.000000248221113e-08 | 1.435406817330676e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -4.175812933000000e+01 | -4.000000330961484e-08 | -1.913875756440901e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -4.175812928000000e+01 | 1.000000082740371e-08 | 4.784689391102254e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -4.175812927000000e+01 | 2.000000165480742e-08 | 9.569378782204507e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -4.175812929000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |