Match comparison for y (H) (t=200 au) (match type 17042)

Commits > Commit 4e4258e65e606bf002e3af34a10a78b31d6cc70d > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
6.025029371038001e-17 1.000000000000000e-04 1.001873304219982e-16 1.149160214742341e-16 -7.190561802904478e-17 2.249536959727979e-16 PASS

Checks for this match

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Detailed information

Reference: 0.00000000000000006025029371038, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] 1.506134497285998e-16 9.036315601821984e-17 9.036315601821983e-13 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 1.506134497285998e-16 9.036315601821984e-17 9.036315601821983e-13 PASS
foss-serial-full: [foss2023a-serial] 1.530480779437531e-16 9.279778423337308e-17 9.279778423337307e-13 PASS
foss-ppc: [foss2022a-serial] -2.968593140018426e-16 -3.571096077122226e-16 -3.571096077122226e-12 PASS
foss-serial-full: [foss2023b-serial] 1.530480779437531e-16 9.279778423337308e-17 9.279778423337307e-13 PASS
foss-opt-full: [foss2023a-serial] 1.530480779437531e-16 9.279778423337308e-17 9.279778423337307e-13 PASS
intel_omp_autotools: [intel2022a-serial] 4.114809919866403e-17 -1.910219451171598e-17 -1.910219451171598e-13 PASS
intel_omp_autotools: [intel2023a-serial] 4.114809919866403e-17 -1.910219451171598e-17 -1.910219451171598e-13 PASS
foss_cmake: [foss2022a-serial, foss-full] 1.530480779437531e-16 9.279778423337308e-17 9.279778423337307e-13 PASS
intel-serial: [intel2023a-serial] 4.114809919866403e-17 -1.910219451171598e-17 -1.910219451171598e-13 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 1.530480779437531e-16 9.279778423337308e-17 9.279778423337307e-13 PASS
foss-mpi-opt-full: [foss2023a-mpi] 1.530480779437531e-16 9.279778423337308e-17 9.279778423337307e-13 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 1.530480779437531e-16 9.279778423337308e-17 9.279778423337307e-13 PASS
foss-mpi-full: [foss2023a-mpi] 1.530480779437531e-16 9.279778423337308e-17 9.279778423337307e-13 PASS
cuda-serial: [foss2022a-cuda-mpi] 1.506134497285998e-16 9.036315601821984e-17 9.036315601821983e-13 PASS