Match comparison for Exchange energy (match type 28349)
Commits >
Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 >
Input 09-basis_from_states.03-intersite.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -5.569326119999999e+00 | 2.780000000000000e-07 | -5.569326060000002e+00 | 1.776356839400250e-15 | -5.569326060000000e+00 | 0.000000000000000e+00 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -5.5693261199999995, precision: 0.000000278| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-ppc: [foss2022a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -5.569326060000000e+00 | 5.999999963535174e-08 | 2.158273368178120e-01 | PASS |