Match comparison for Exchange energy (match type 21130)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-1.259799677000000e+01 | 2.050000000000000e-02 | -1.260136777538461e+01 | 2.309255409376030e-03 | -1.259770155500000e+01 | 4.333274999999581e-03 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -12.59799677, precision: 0.0205Run | Value | Difference | Relative difference | Status |
foss-ppc: [foss2022a-serial] | -1.260203441000000e+01 | -4.037639999999953e-03 | -1.969580487804855e-01 | PASS |
foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | -1.260203437000000e+01 | -4.037600000000197e-03 | -1.969560975609852e-01 | PASS |
foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | -1.260203483000000e+01 | -4.038059999999177e-03 | -1.969785365853257e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | -1.260203441000000e+01 | -4.037639999999953e-03 | -1.969580487804855e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | -1.260203453000000e+01 | -4.037759999999224e-03 | -1.969639024389865e-01 | PASS |
foss-serial-full: [foss2023a-serial] | -1.260203439000000e+01 | -4.037620000000075e-03 | -1.969570731707354e-01 | PASS |
intel_omp_autotools: [intel2022a-serial] | -1.259336828000000e+01 | 4.628489999999985e-03 | 2.257799999999993e-01 | PASS |
intel_omp_autotools: [intel2023a-serial] | -1.259336828000000e+01 | 4.628489999999985e-03 | 2.257799999999993e-01 | PASS |
foss-serial-debug: [foss2023a-serial] | -1.260203439000000e+01 | -4.037620000000075e-03 | -1.969570731707354e-01 | PASS |
foss-serial-full: [foss2023b-serial] | -1.260203439000000e+01 | -4.037620000000075e-03 | -1.969570731707354e-01 | PASS |
foss-opt-full: [foss2023a-serial] | -1.260203439000000e+01 | -4.037620000000075e-03 | -1.969570731707354e-01 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | -1.260203432000000e+01 | -4.037549999999612e-03 | -1.969536585365664e-01 | PASS |
intel-serial: [intel2023a-serial] | -1.260203429000000e+01 | -4.037520000000683e-03 | -1.969521951219845e-01 | PASS |
foss-omp-full: [foss2023a-serial] | -1.260203445000000e+01 | -4.037679999999710e-03 | -1.969599999999859e-01 | PASS |
foss-mpi-opt-full: [foss2023a-mpi] | -1.260203446000000e+01 | -4.037690000000538e-03 | -1.969604878049043e-01 | PASS |
foss-mpi-full: [foss2023a-mpi] | -1.260203446000000e+01 | -4.037690000000538e-03 | -1.969604878049043e-01 | PASS |
foss-mpi-debug: [foss2023a-mpi] | -1.260203446000000e+01 | -4.037690000000538e-03 | -1.969604878049043e-01 | PASS |
foss-mpi-omp-full: [foss2023a-mpi] | -1.260203434000000e+01 | -4.037569999999491e-03 | -1.969546341463166e-01 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | -1.260203442000000e+01 | -4.037650000000781e-03 | -1.969585365854039e-01 | PASS |
foss-serial-min: [foss2023a-serial] | -1.260203434000000e+01 | -4.037569999999491e-03 | -1.969546341463166e-01 | PASS |
foss-serial-min: [foss2023b-serial] | -1.260203434000000e+01 | -4.037569999999491e-03 | -1.969546341463166e-01 | PASS |
foss-serial-min: [foss2022a-serial] | -1.260203434000000e+01 | -4.037569999999491e-03 | -1.969546341463166e-01 | PASS |
foss-mpi-min: [foss2023a-mpi] | -1.260203438000000e+01 | -4.037609999999248e-03 | -1.969565853658169e-01 | PASS |
foss-mpi-min: [foss2022a-mpi] | -1.260203438000000e+01 | -4.037609999999248e-03 | -1.969565853658169e-01 | PASS |
cuda-serial: [foss2022a-cuda-mpi] | -1.260203418000000e+01 | -4.037410000000463e-03 | -1.969468292683153e-01 | PASS |
cuda-mpi-omp: [foss2022a-cuda-mpi] | -1.260203433000000e+01 | -4.037560000000440e-03 | -1.969541463414849e-01 | PASS |