Match comparison for Fx (H) (t=200 au) (match type 17053)

Commits > Commit 9c5e1a9ae4a97d24a493b8c6c0caa96edfef5d41 > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-8.710019608717000e-03 1.000000000000000e-04 -8.710019608360639e-03 9.602657531016237e-14 -8.710019608377348e-03 1.561112350501048e-13 PASS
Checks do not indicate problems with this match.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -0.008710019608717, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] -8.710019608533459e-03 1.835406826522501e-13 1.835406826522501e-09 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -8.710019608533459e-03 1.835406826522501e-13 1.835406826522501e-09 PASS
foss_autotools: [foss2023a-serial] -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
foss_autotools: [foss2022a-serial] -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
foss_autotools: [foss2023b-serial] -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
intel_omp_autotools: [intel2022a-serial] -8.710019608359182e-03 3.578179419427840e-13 3.578179419427840e-09 PASS
intel_omp_autotools: [intel2023a-serial] -8.710019608359182e-03 3.578179419427840e-13 3.578179419427840e-09 PASS
foss-opt-full: [foss2023a-serial] -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
foss_cmake: [foss2022a-serial, foss-full] -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
foss_ppc_autotools: [foss2022a-serial] -8.710019608221237e-03 4.957631527524597e-13 4.957631527524597e-09 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
intel_autotools: [intel2023a-serial] -8.710019608359182e-03 3.578179419427840e-13 3.578179419427840e-09 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -8.710019608533459e-03 1.835406826522501e-13 1.835406826522501e-09 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS