Match comparison for Force C2 (z) (match type 29551)
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Input 12-vdw_solid_c6.02-gs_graphene.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 0.000000000000000e+00 | 4.000000000000000e-15 | 4.345287784814816e-16 | 4.466779684349289e-16 | 6.249963175000001e-16 | 7.695639825000000e-16 | PASS |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 0.0, precision: 0.000000000000004| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_min | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| spack_foss-2023a_serial_opt | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| spack_foss-2022a_serial | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| spack_foss-2022a_serial_min | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| spack_foss-2022a_ppc | 1.086782280000000e-15 | 1.086782280000000e-15 | 2.716955700000000e-01 | PASS |
| spack_foss-2023a_serial | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| spack_foss-2023b_serial | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| spack_foss-2022a_mpi_min | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| spack_foss-2023a_mpi_min | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| spack_foss-2023a_serial_omp | 1.184500040000000e-15 | 1.184500040000000e-15 | 2.961250100000000e-01 | PASS |
| spack_foss-2023a_mpi_opt | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| spack_foss-2022a_mpi | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| spack_foss-2023a_mpi | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| spack_foss-2023a_serial_debug | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-min] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss_opt_autotools: [foss2023a-serial] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-full] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| spack_foss-2023a_mpi_debug | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| GCI_intel_autotools: [intel2023a-serial] | 1.598229300000000e-16 | 1.598229300000000e-16 | 3.995573249999999e-02 | PASS |
| GCI_intel_omp_autotools: [intel2023a-serial] | 9.641582640000001e-16 | 9.641582640000001e-16 | 2.410395660000000e-01 | PASS |
| GCI_intel_omp_autotools: [intel2022a-serial] | 1.254417920000000e-15 | 1.254417920000000e-15 | 3.136044800000000e-01 | PASS |
| GCI_foss_omp_autotools: [foss2023a-serial] | 1.184500040000000e-15 | 1.184500040000000e-15 | 2.961250100000000e-01 | PASS |
| GCI_foss_ppc_autotools: [foss2022a-serial] | 1.086782280000000e-15 | 1.086782280000000e-15 | 2.716955700000000e-01 | PASS |
| GCI_foss_min_autotools: [foss2022a-serial] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss_min_autotools: [foss2023a-serial] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss_min_autotools: [foss2023b-serial] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss_autotools: [foss2022a-serial] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss_autotools: [foss2023b-serial] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss_autotools: [foss2023a-serial] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| GCI_foss_debug_autotools: [foss2023a-serial] | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| spack_foss-2023a_mpi_omp | 8.813415980000000e-16 | 8.813415980000000e-16 | 2.203353995000000e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | 8.813415980000000e-16 | 8.813415980000000e-16 | 2.203353995000000e-01 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| cmake_foss_2022a_full_serial | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| cmake_foss_2022a_min_serial | 2.132453960000000e-16 | 2.132453960000000e-16 | 5.331134899999999e-02 | PASS |
| cmake_foss_2022a_min_mpi | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| cmake_foss_2022a_full_mpi | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| spack_intel-2022a_impi_omp | 1.156778510000000e-15 | 1.156778510000000e-15 | 2.891946275000000e-01 | PASS |
| spack_intel-2023a_serial | 1.598229300000000e-16 | 1.598229300000000e-16 | 3.995573249999999e-02 | PASS |
| spack_intel-2022a_serial_omp | 1.254417920000000e-15 | 1.254417920000000e-15 | 3.136044800000000e-01 | PASS |
| spack_intel-2023a_serial_omp | 9.641582640000001e-16 | 9.641582640000001e-16 | 2.410395660000000e-01 | PASS |
| spack_intel-2023a_impi | -1.445676650000000e-16 | -1.445676650000000e-16 | -3.614191625000000e-02 | PASS |
| GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] | 1.287849890000000e-15 | 1.287849890000000e-15 | 3.219624725000000e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 1.394560300000000e-15 | 1.394560300000000e-15 | 3.486400750000000e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| GCI_foss_mpi_min_autotools: [foss2022a-mpi] | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| GCI_foss_mpi_min_autotools: [foss2023a-mpi] | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |
| spack_foss-2022a_cuda_serial | 1.287849890000000e-15 | 1.287849890000000e-15 | 3.219624725000000e-01 | PASS |
| GCI_intel_mpi_autotools: [intel2023a-mpi] | -1.445676650000000e-16 | -1.445676650000000e-16 | -3.614191625000000e-02 | PASS |
| GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | 1.156778510000000e-15 | 1.156778510000000e-15 | 2.891946275000000e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | 1.472602300000000e-16 | 1.472602300000000e-16 | 3.681505750000000e-02 | PASS |