Match comparison for Forces [step 20] (match type 22548)
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Input 05-time_propagation.06-td_fast_md.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -9.513371027100001e-03 | 4.760000000000000e-12 | -9.513371027087915e-03 | 6.056195241866162e-15 | -9.513371027082940e-03 | 1.620925615952729e-14 | PASS |
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Detailed information
Reference: -0.0095133710271, precision: 0.00000000000476| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_min | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| spack_foss-2023a_serial_opt | -9.513371027088491e-03 | 1.150989026310612e-14 | 2.418044172921453e-03 | PASS |
| spack_foss-2022a_serial | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| spack_foss-2022a_serial_min | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| spack_foss-2022a_ppc | -9.513371027066730e-03 | 3.327026154575918e-14 | 6.989550744907392e-03 | PASS |
| spack_foss-2023a_serial | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| spack_foss-2023b_serial | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| spack_foss-2022a_mpi_min | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| spack_foss-2023a_mpi_min | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| spack_foss-2023a_serial_omp | -9.513371027087381e-03 | 1.262011328773127e-14 | 2.651284304145225e-03 | PASS |
| spack_foss-2023a_mpi_opt | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| spack_foss-2022a_mpi | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| spack_foss-2023a_mpi | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| spack_foss-2023a_serial_debug | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-min] | -9.513371027088491e-03 | 1.150989026310612e-14 | 2.418044172921453e-03 | PASS |
| GCI_foss_opt_autotools: [foss2023a-serial] | -9.513371027088491e-03 | 1.150989026310612e-14 | 2.418044172921453e-03 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-full] | -9.513371027088491e-03 | 1.150989026310612e-14 | 2.418044172921453e-03 | PASS |
| spack_foss-2023a_mpi_debug | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| GCI_intel_autotools: [intel2023a-serial] | -9.513371027095596e-03 | 4.404462905505113e-15 | 9.253073330893095e-04 | PASS |
| GCI_intel_omp_autotools: [intel2023a-serial] | -9.513371027099149e-03 | 8.517492267046123e-16 | 1.789389131732379e-04 | PASS |
| GCI_intel_omp_autotools: [intel2022a-serial] | -9.513371027099149e-03 | 8.517492267046123e-16 | 1.789389131732379e-04 | PASS |
| GCI_foss_omp_autotools: [foss2023a-serial] | -9.513371027087381e-03 | 1.262011328773127e-14 | 2.651284304145225e-03 | PASS |
| GCI_foss_ppc_autotools: [foss2022a-serial] | -9.513371027066730e-03 | 3.327026154575918e-14 | 6.989550744907392e-03 | PASS |
| GCI_foss_min_autotools: [foss2022a-serial] | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| GCI_foss_min_autotools: [foss2023a-serial] | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| GCI_foss_min_autotools: [foss2023b-serial] | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| GCI_foss_autotools: [foss2022a-serial] | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| GCI_foss_autotools: [foss2023b-serial] | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| GCI_foss_autotools: [foss2023a-serial] | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| GCI_foss_debug_autotools: [foss2023a-serial] | -9.513371027087603e-03 | 1.239806868280624e-14 | 2.604636277900471e-03 | PASS |
| spack_foss-2023a_mpi_omp | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| cmake_foss_2022a_full_serial | -9.513371027088491e-03 | 1.150989026310612e-14 | 2.418044172921453e-03 | PASS |
| cmake_foss_2022a_min_serial | -9.513371027088491e-03 | 1.150989026310612e-14 | 2.418044172921453e-03 | PASS |
| cmake_foss_2022a_min_mpi | -9.513371027085604e-03 | 1.439647012713152e-14 | 3.024468514103261e-03 | PASS |
| cmake_foss_2022a_full_mpi | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| spack_intel-2022a_impi_omp | -9.513371027094930e-03 | 5.070596720280207e-15 | 1.065251411823573e-03 | PASS |
| spack_intel-2023a_serial | -9.513371027095596e-03 | 4.404462905505113e-15 | 9.253073330893095e-04 | PASS |
| spack_intel-2022a_serial_omp | -9.513371027099149e-03 | 8.517492267046123e-16 | 1.789389131732379e-04 | PASS |
| spack_intel-2023a_serial_omp | -9.513371027099149e-03 | 8.517492267046123e-16 | 1.789389131732379e-04 | PASS |
| spack_intel-2023a_impi | -9.513371027096484e-03 | 3.516284485804988e-15 | 7.387152281102916e-04 | PASS |
| GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] | -9.513371027092488e-03 | 7.513087374455552e-15 | 1.578379700515872e-03 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -9.513371027094264e-03 | 5.736730535055301e-15 | 1.205195490557836e-03 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | -9.513371027084272e-03 | 1.572873775668171e-14 | 3.304356671571788e-03 | PASS |
| GCI_foss_mpi_min_autotools: [foss2022a-mpi] | -9.513371027086936e-03 | 1.306420249758133e-14 | 2.744580356634734e-03 | PASS |
| GCI_foss_mpi_min_autotools: [foss2023a-mpi] | -9.513371027086936e-03 | 1.306420249758133e-14 | 2.744580356634734e-03 | PASS |
| spack_foss-2022a_cuda_serial | -9.513371027092488e-03 | 7.513087374455552e-15 | 1.578379700515872e-03 | PASS |
| GCI_intel_mpi_autotools: [intel2023a-mpi] | -9.513371027093598e-03 | 6.402864349830395e-15 | 1.345139569292100e-03 | PASS |
| GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | -9.513371027092488e-03 | 7.513087374455552e-15 | 1.578379700515872e-03 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | -9.513371027085604e-03 | 1.439647012713152e-14 | 3.024468514103261e-03 | PASS |