Match comparison for H2 Multipole z (match type 15361)
Commits >
Commit ea6affb390844fd1d159151b43e705a091215c1a >
Input 30-local_multipoles.03-multipoles_restart.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 3.942026147098392e-01 | 3.940000000000000e-15 | 3.942026147098408e-01 | 1.220614355551321e-15 | 3.942026147098392e-01 | 2.942091015256665e-15 | PASS |
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Detailed information
Reference: 0.3942026147098392, precision: 0.00000000000000394| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | 3.942026147098417e-01 | 2.498001805406602e-15 | 6.340106105092899e-01 | PASS |
| spack_foss-2023a_serial_opt | 3.942026147098402e-01 | 9.992007221626409e-16 | 2.536042442037160e-01 | PASS |
| spack_foss-2023a_serial | 3.942026147098417e-01 | 2.498001805406602e-15 | 6.340106105092899e-01 | PASS |
| spack_foss-2023a_serial_min | 3.942026147098417e-01 | 2.498001805406602e-15 | 6.340106105092899e-01 | PASS |
| spack_foss-2023b_serial | 3.942026147098417e-01 | 2.498001805406602e-15 | 6.340106105092899e-01 | PASS |
| spack_foss-2022a_serial | 3.942026147098417e-01 | 2.498001805406602e-15 | 6.340106105092899e-01 | PASS |
| spack_foss-2022a_mpi_min | 3.942026147098414e-01 | 2.164934898019055e-15 | 5.494758624413846e-01 | PASS |
| spack_foss-2022a_ppc | 3.942026147098363e-01 | -2.886579864025407e-15 | -7.326344832551794e-01 | PASS |
| spack_foss-2023a_mpi_min | 3.942026147098414e-01 | 2.164934898019055e-15 | 5.494758624413846e-01 | PASS |
| spack_foss-2023a_serial_omp | 3.942026147098422e-01 | 2.997602166487923e-15 | 7.608127326111479e-01 | PASS |
| spack_foss-2022a_mpi | 3.942026147098414e-01 | 2.164934898019055e-15 | 5.494758624413846e-01 | PASS |
| spack_foss-2023a_mpi | 3.942026147098414e-01 | 2.164934898019055e-15 | 5.494758624413846e-01 | PASS |
| spack_foss-2023a_serial_debug | 3.942026147098417e-01 | 2.498001805406602e-15 | 6.340106105092899e-01 | PASS |
| spack_foss-2023a_mpi_debug | 3.942026147098414e-01 | 2.164934898019055e-15 | 5.494758624413846e-01 | PASS |
| spack_foss-2023a_mpi_omp | 3.942026147098415e-01 | 2.275957200481571e-15 | 5.776541117973530e-01 | PASS |
| cmake_foss_2022a_full_serial | 3.942026147098402e-01 | 9.992007221626409e-16 | 2.536042442037160e-01 | PASS |
| cmake_foss_2022a_min_serial | 3.942026147098402e-01 | 9.992007221626409e-16 | 2.536042442037160e-01 | PASS |
| cmake_foss_2022a_min_mpi | 3.942026147098404e-01 | 1.221245327087672e-15 | 3.099607429156528e-01 | PASS |
| cmake_foss_2022a_full_mpi | 3.942026147098400e-01 | 7.771561172376096e-16 | 1.972477454917791e-01 | PASS |
| spack_intel-2023a_serial | 3.942026147098408e-01 | 1.609823385706477e-15 | 4.085846156615424e-01 | PASS |
| spack_intel-2022a_impi_omp | 3.942026147098414e-01 | 2.164934898019055e-15 | 5.494758624413846e-01 | PASS |
| spack_intel-2022a_serial_omp | 3.942026147098392e-01 | 5.551115123125783e-17 | 1.408912467798422e-02 | PASS |
| spack_intel-2023a_serial_omp | 3.942026147098392e-01 | 5.551115123125783e-17 | 1.408912467798422e-02 | PASS |
| spack_intel-2023a_impi | 3.942026147098391e-01 | -5.551115123125783e-17 | -1.408912467798422e-02 | PASS |
| spack_foss-2023a_mpi_opt | 3.942026147098400e-01 | 7.771561172376096e-16 | 1.972477454917791e-01 | PASS |
| spack_foss-2023a_valgrind | 3.942026147098422e-01 | 2.997602166487923e-15 | 7.608127326111479e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 3.942026147098411e-01 | 1.942890293094024e-15 | 4.931193637294477e-01 | PASS |
| spack_foss-2022a_cuda_serial | 3.942026147098413e-01 | 2.109423746787797e-15 | 5.353867377634004e-01 | PASS |