Match comparison for Fz (O) (t=200 au) (match type 17049)

Commits > Commit bb161c2d0107cec853e686df3a469ebc444968d7 > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-9.060493832761000e-03 1.000000000000000e-04 -9.060493832367110e-03 3.046123993786488e-13 -9.060493832568892e-03 5.502681643676510e-13 PASS

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Detailed information

Reference: -0.009060493832761, precision: 0.0001
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-full] -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
foss_autotools: [foss2022a-serial] -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
foss_opt_autotools: [foss2023a-serial] -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
foss_autotools: [foss2023b-serial] -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
intel_autotools: [intel2023a-serial] -9.060493832018623e-03 7.423766462677506e-13 7.423766462677506e-09 PASS
foss_autotools: [foss2023a-serial] -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
foss_omp_autotools: [foss2023a-serial] -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
intel_omp_autotools: [intel2023a-serial] -9.060493832018623e-03 7.423766462677506e-13 7.423766462677506e-09 PASS
intel_omp_autotools: [intel2022a-serial] -9.060493832018623e-03 7.423766462677506e-13 7.423766462677506e-09 PASS
foss_ppc_autotools: [foss2022a-serial] -9.060493833119160e-03 -3.581596824675515e-13 -3.581596824675515e-09 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -9.060493832886679e-03 -1.256789811110437e-13 -1.256789811110437e-09 PASS