Match comparison for N_electrons [step 1112] (match type 24581)
Commits >
Commit 08b73ec86c1ce3969ff61040f8f54a592910f9b6 >
Input 04-lithium.02-absorbing_boundaries.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 2.353010052117660e+00 | 3.500000000000000e-07 | 2.353009916624676e+00 | 7.081441442620073e-08 | 2.353010017433755e+00 | 2.003895782642928e-07 | PASS |
Checks for this match
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Detailed information
Reference: 2.35301005211766, precision: 0.00000035| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_ppc | 2.353010217823333e+00 | 1.657056731829698e-07 | 4.734447805227709e-01 | PASS |
| cmake_foss_2022a_full_mpi | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| cmake_foss_2022a_full_serial | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| cmake_foss_2022a_min_serial | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| cmake_foss_2022a_min_mpi | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2022a_cuda_serial | 2.353009973298092e+00 | -7.881956820554592e-08 | -2.251987663015598e-01 | PASS |
| spack_foss-2022a_serial | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2022a_serial_min | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2022a_mpi_min | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2022a_mpi | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 2.353009932449979e+00 | -1.196676810977237e-07 | -3.419076602792107e-01 | PASS |
| spack_foss-2023a_mpi_min | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2023a_mpi | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2023a_serial | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2023a_serial_min | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2023a_mpi_opt | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2023a_serial_opt | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2023a_serial_debug | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2023b_serial | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |
| spack_foss-2023a_serial_omp | 2.353009854434333e+00 | -1.976833265970868e-07 | -5.648095045631051e-01 | PASS |
| spack_foss-2023a_mpi_omp | 2.353009854434333e+00 | -1.976833265970868e-07 | -5.648095045631051e-01 | PASS |
| spack_intel-2023a_serial | 2.353009817044176e+00 | -2.350734833456158e-07 | -6.716385238446168e-01 | PASS |
| spack_intel-2022a_serial_omp | 2.353009886182176e+00 | -1.659354835759075e-07 | -4.741013816454500e-01 | PASS |
| spack_intel-2023a_impi | 2.353009817044176e+00 | -2.350734833456158e-07 | -6.716385238446168e-01 | PASS |
| spack_intel-2023a_serial_omp | 2.353010006622140e+00 | -4.549552024002423e-08 | -1.299872006857835e-01 | PASS |
| spack_intel-2022a_impi_omp | 2.353009886182176e+00 | -1.659354835759075e-07 | -4.741013816454500e-01 | PASS |
| spack_foss-2023a_valgrind | 2.353009823373599e+00 | -2.287440605819313e-07 | -6.535544588055181e-01 | PASS |
| spack_foss-2023a_mpi_debug | 2.353009917447201e+00 | -1.346704583404801e-07 | -3.847727381156574e-01 | PASS |