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

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-8.710019608717000e-03 1.000000000000000e-04 -8.710019608295603e-03 1.480126013854082e-13 -8.710019608257347e-03 3.792244296363378e-13 PASS

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Detailed information

Reference: -0.008710019608717, precision: 0.0001
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
foss-2022a_ppc -8.710019608221237e-03 4.957631527524597e-13 4.957631527524597e-09 PASS
spack_foss-2022a_serial_opt -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
spack_foss-2022a_serial -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
foss-2022a_opt -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
intel-2022b -8.710019607878122e-03 8.388775785128644e-13 8.388775785128644e-09 PASS
intel-2022a -8.710019608359182e-03 3.578179419427840e-13 3.578179419427840e-09 PASS
spack_foss-2022a_serial_omp -8.710019608267172e-03 4.498276751085939e-13 4.498276751085939e-09 PASS
cmake_foss_2022a_full_mpi -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
foss-2022a_omp -8.710019608267172e-03 4.498276751085939e-13 4.498276751085939e-09 PASS
intel-2022a_omp -8.710019608359182e-03 3.578179419427840e-13 3.578179419427840e-09 PASS
eb_fosscuda-2022a -8.710019608636571e-03 8.042871924018868e-14 8.042871924018868e-10 PASS
eb_foss-2022a -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS
eb_foss-2022b_libxc6 -8.710019608307112e-03 4.098874017977039e-13 4.098874017977039e-09 PASS