Match comparison for Hartree energy (match type 29833)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -5.236158373600000e+02 | 1.750000000000000e-06 | -5.236158380025806e+02 | 3.699605039668741e-07 | -5.236158381150001e+02 | 8.349999802703678e-07 | PASS |
Checks for this match
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Detailed information
Reference: -523.61583736, precision: 0.00000175| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2023a-serial] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -5.236158373100000e+02 | 5.000003966415534e-08 | 2.857145123666019e-02 | PASS |
| foss_autotools: [foss2023a-serial] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -5.236158381499999e+02 | -7.899999445726280e-07 | -4.514285397557875e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -5.236158373000000e+02 | 6.000004759698641e-08 | 3.428574148399223e-02 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -5.236158381000000e+02 | -7.400000185953104e-07 | -4.228571534830345e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -5.236158373300000e+02 | 3.000002379849320e-08 | 1.714287074199611e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss-cmake: [foss2022a-serial, foss-min] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss-cmake: [foss2022a-serial, foss-full] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss-cmake: [foss2022a-mpi, foss-min-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss-cmake: [foss2023a-mpi, foss-full-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss-cmake: [foss2022a-mpi, foss-full-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -5.236158373100000e+02 | 5.000003966415534e-08 | 2.857145123666019e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -5.236158381499999e+02 | -7.899999445726280e-07 | -4.514285397557875e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -5.236158373100000e+02 | 5.000003966415534e-08 | 2.857145123666019e-02 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | -5.236158389500000e+02 | -1.590000010764925e-06 | -9.085714347228142e-01 | PASS |
| foss-cmake: [foss2023a-mpi, foss-min-mpi] | -5.236158381400001e+02 | -7.800000503266347e-07 | -4.457143144723626e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -5.236158372800001e+02 | 7.999994977581082e-08 | 4.571425701474904e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -5.236158380900000e+02 | -7.300000106624793e-07 | -4.171428632357025e-01 | PASS |