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

Commits > Commit 77b19a812457519ffe2e63888ffe5f5b10958dc8 > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
8.710019608157000e-03 1.000000000000000e-04 8.710019608357695e-03 8.653668836870853e-14 8.710019608369604e-03 1.484506961801912e-13 PASS
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Detailed information

Reference: 0.008710019608157, precision: 0.0001
Run Value Difference Relative difference Status
foss-2022a_ppc 8.710019608221153e-03 6.415354358857428e-14 6.415354358857428e-10 PASS
cmake_foss_2022a_full_serial 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
cmake_foss_2022a_full_mpi 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
eb_foss-2022a 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
eb_foss-2022b_libxc6 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
foss-2022a_opt 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
eb_fosscuda-2022a 8.710019608402342e-03 2.453419412073998e-13 2.453419412073998e-09 PASS
intel-2022a 8.710019608359237e-03 2.022375322763281e-13 2.022375322763281e-09 PASS
foss-2022a_omp 8.710019608518055e-03 3.610549359489568e-13 3.610549359489568e-09 PASS
intel-2022b 8.710019608479669e-03 3.226689748725420e-13 3.226689748725420e-09 PASS
spack_foss-2022a_serial 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
intel-2022a_omp 8.710019608359237e-03 2.022375322763281e-13 2.022375322763281e-09 PASS
spack_foss-2022a_serial_opt 8.710019608307140e-03 1.501403168457927e-13 1.501403168457927e-09 PASS
spack_foss-2022a_serial_omp 8.710019608518055e-03 3.610549359489568e-13 3.610549359489568e-09 PASS