Match comparison for Hubbard energy (match type 28353)
Commits >
Commit bb686499811dbfe67b92ca3aeb5b2659998636fa >
Input 09-basis_from_states.03-intersite.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.473539340000000e+00 | 1.240000000000000e-07 | -2.473539330740741e+00 | 1.687117327847452e-08 | -2.473539345000000e+00 | 4.499999994855841e-08 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -2.47353934, precision: 0.000000124| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2022a_serial_min | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2022a_serial | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2022a_ppc | -2.473539390000000e+00 | -5.000000014021566e-08 | -4.032258075823844e-01 | PASS |
| spack_foss-2022a_mpi_min | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_full_mpi | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_mpi | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_min_serial | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2023a_mpi | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_min_mpi | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-min] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_opt_autotools: [foss2023a-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-full] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_intel_autotools: [intel2023a-serial] | -2.473539300000000e+00 | 3.999999975690116e-08 | 3.225806432008158e-01 | PASS |
| GCI_foss_omp_autotools: [foss2023a-serial] | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_intel_omp_autotools: [intel2023a-serial] | -2.473539360000000e+00 | -2.000000032253979e-08 | -1.612903251817725e-01 | PASS |
| GCI_intel_omp_autotools: [intel2022a-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_intel_mpi_autotools: [intel2023a-mpi] | -2.473539330000000e+00 | 9.999999939225290e-09 | 8.064516080020395e-02 | PASS |
| spack_foss-2023a_mpi_debug | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_foss_ppc_autotools: [foss2022a-serial] | -2.473539390000000e+00 | -5.000000014021566e-08 | -4.032258075823844e-01 | PASS |
| GCI_foss_min_autotools: [foss2022a-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_min_autotools: [foss2023a-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2023a_mpi_min | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_foss_min_autotools: [foss2023b-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_autotools: [foss2022a-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_autotools: [foss2023a-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_autotools: [foss2023b-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_debug_autotools: [foss2023a-serial] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2023a_serial | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_mpi_min_autotools: [foss2022a-mpi] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_mpi_min_autotools: [foss2023a-mpi] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2023a_mpi_opt | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2023a_serial_debug | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2023a_serial_min | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2023a_serial_opt | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2023a_mpi_omp | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2023b_serial | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2023a_serial_omp | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_intel-2023a_serial | -2.473539300000000e+00 | 3.999999975690116e-08 | 3.225806432008158e-01 | PASS |
| spack_intel-2022a_serial_omp | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_intel-2023a_serial_omp | -2.473539360000000e+00 | -2.000000032253979e-08 | -1.612903251817725e-01 | PASS |
| spack_intel-2023a_impi | -2.473539330000000e+00 | 9.999999939225290e-09 | 8.064516080020395e-02 | PASS |
| spack_intel-2022a_impi_omp | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_cuda_serial | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | -2.473539320000000e+00 | 1.999999987845058e-08 | 1.612903216004079e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | -2.473539340000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |