Match comparison for Hartree energy (match type 28477)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
1.212923650000000e+01 | 6.060000000000000e-07 | 1.212923645000000e+01 | 1.776356839400250e-15 | 1.212923645000000e+01 | 0.000000000000000e+00 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 12.1292365, precision: 0.000000606Run | Value | Difference | Relative difference | Status |
foss-cmake-zen4: [foss2023a-serial, foss-min] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
intel_autotools: [intel2023a-serial] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
intel_omp_autotools: [intel2023a-serial] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
foss-ppc: [foss2022a-serial] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
foss-serial-full: [foss2023a-serial] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
foss-serial-min: [foss2023b-serial] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
foss-opt-full: [foss2023a-serial] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
foss-serial-min: [foss2022a-serial] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
foss-serial-min: [foss2023a-serial] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
foss-cmake-zen4: [foss2023a-serial, foss-full] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
cuda-mpi: [foss2022a-cuda-mpi] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 1.212923645000000e+01 | -4.999999880794803e-08 | -8.250824885800005e-02 | PASS |