Match comparison for Fx (H) (t=200 au) (match type 17050)

Commits > Commit 6873b983d1904fe0612bd483f61737dd2d8ed971 > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
8.710019608157000e-03 1.000000000000000e-04 8.710019608355586e-03 9.090173472577687e-14 8.710019608373545e-03 1.523919879176105e-13 PASS
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Detailed information

Reference: 0.008710019608157, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] 8.710019608525937e-03 3.689375194237954e-13 3.689375194237954e-09 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 8.710019608525937e-03 3.689375194237954e-13 3.689375194237954e-09 PASS
intel_autotools: [intel2023a-serial] 8.710019608359237e-03 2.022375322763281e-13 2.022375322763281e-09 PASS
foss-serial-full: [foss2023a-serial] 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
foss_cmake: [foss2022a-serial, foss-full] 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
foss-serial-full: [foss2023b-serial] 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
foss-opt-full: [foss2023a-serial] 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
intel_omp_autotools: [intel2023a-serial] 8.710019608359237e-03 2.022375322763281e-13 2.022375322763281e-09 PASS
foss-ppc: [foss2022a-serial] 8.710019608221153e-03 6.415354358857428e-14 6.415354358857428e-10 PASS
intel_omp_autotools: [intel2022a-serial] 8.710019608359237e-03 2.022375322763281e-13 2.022375322763281e-09 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
foss-mpi-opt-full: [foss2023a-mpi] 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
foss-mpi-full: [foss2023a-mpi] 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 8.710019608525937e-03 3.689375194237954e-13 3.689375194237954e-09 PASS