Match comparison for Hartree energy (match type 30359)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 8.788829173000001e+01 | 1.410000000000000e-05 | 8.788828955133333e+01 | 4.794390286818538e-06 | 8.788828740000000e+01 | 6.800000001305762e-06 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: 87.88829173, precision: 0.0000141| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 8.788829169000000e+01 | -4.000000330961484e-08 | -2.836879667348570e-03 | PASS |
| foss_min_autotools: [foss2023a-serial] | 8.788828060000000e+01 | -1.113000000430020e-05 | -7.893617024326383e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 8.788829285000000e+01 | 1.119999993193233e-06 | 7.943262363072570e-02 | PASS |
| foss_min_autotools: [foss2022a-serial] | 8.788829169000000e+01 | -4.000000330961484e-08 | -2.836879667348570e-03 | PASS |
| foss_min_autotools: [foss2023b-serial] | 8.788828060000000e+01 | -1.113000000430020e-05 | -7.893617024326383e-01 | PASS |
| foss_autotools: [foss2022a-serial] | 8.788829169000000e+01 | -4.000000330961484e-08 | -2.836879667348570e-03 | PASS |
| foss_autotools: [foss2023b-serial] | 8.788828060000000e+01 | -1.113000000430020e-05 | -7.893617024326383e-01 | PASS |
| intel_autotools: [intel2023a-serial] | 8.788829144000000e+01 | -2.900000026784255e-07 | -2.056737607648408e-02 | PASS |
| foss_autotools: [foss2023a-serial] | 8.788828060000000e+01 | -1.113000000430020e-05 | -7.893617024326383e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 8.788828060000000e+01 | -1.113000000430020e-05 | -7.893617024326383e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 8.788829420000000e+01 | 2.469999998311323e-06 | 1.751773048447747e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 8.788829161000000e+01 | -1.200000099288445e-07 | -8.510639002045709e-03 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 8.788829420000000e+01 | 2.469999998311323e-06 | 1.751773048447747e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 8.788829257000000e+01 | 8.399999984476381e-07 | 5.957446797500979e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 8.788829078000001e+01 | -9.500000004436515e-07 | -6.737588655628735e-02 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 8.788829110000000e+01 | -6.300000023884422e-07 | -4.468085123322285e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 8.788829420000000e+01 | 2.469999998311323e-06 | 1.751773048447747e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 8.788829420000000e+01 | 2.469999998311323e-06 | 1.751773048447747e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 8.788829161000000e+01 | -1.200000099288445e-07 | -8.510639002045709e-03 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 8.788829124999999e+01 | -4.800000112936686e-07 | -3.404255399245877e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 8.788828562000000e+01 | -6.110000001058324e-06 | -4.333333334083918e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 8.788829161000000e+01 | -1.200000099288445e-07 | -8.510639002045709e-03 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 8.788828060000000e+01 | -1.113000000430020e-05 | -7.893617024326383e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 8.788829163000000e+01 | -1.000000082740371e-07 | -7.092199168371425e-03 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 8.788829230000000e+01 | 5.699999974240200e-07 | 4.042553173220000e-02 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 8.788829420000000e+01 | 2.469999998311323e-06 | 1.751773048447747e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 8.788828762999999e+01 | -4.100000012385863e-06 | -2.907801427224016e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 8.788829151000000e+01 | -2.200000039920269e-07 | -1.560283716255510e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 8.788829149999999e+01 | -2.300000119248580e-07 | -1.631205758332326e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 8.788829186000000e+01 | 1.299999894399662e-07 | 9.219857407089797e-03 | PASS |