Match comparison for Hartree energy (match type 31750)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
4.615002520000000e+00 | 3.570000000000000e-05 | 4.615016209999999e+00 | 1.776356839400250e-15 | 4.615016210000000e+00 | 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: 4.61500252, precision: 0.0000357Run | Value | Difference | Relative difference | Status |
cuda-mpi-omp: [foss2022a-cuda-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-serial-min: [foss2022a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-serial-min: [foss2023b-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-serial-min: [foss2023a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-opt-full: [foss2023a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-serial-full: [foss2023b-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-serial-full: [foss2023a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
intel_autotools: [intel2023a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-ppc: [foss2022a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-serial-debug: [foss2023a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-mpi-opt-full: [foss2023a-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
intel_omp_autotools: [intel2023a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-omp-full: [foss2023a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
intel_omp_autotools: [intel2022a-serial] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-mpi-full: [foss2023a-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-mpi-debug: [foss2023a-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-mpi-min: [foss2022a-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-mpi-min: [foss2023a-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
foss-mpi-omp-full: [foss2023a-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | 4.615016210000000e+00 | 1.369000000028819e-05 | 3.834733893638150e-01 | PASS |