Input 02-propagators.04-rungekutta4.inp

Commits > Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 > Run spack_foss-2022a_cuda_mpi_omp

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537673799433820e-02 8.537673799433354e-02 5.130000000000000e-15 4.662936703425657e-15 PASS
Forces [step 20] 7.965998233983163e-02 7.965998233982896e-02 2.930000000000000e-15 2.664535259100376e-15 PASS
Energy [step 1] -1.060686608766761e+01 -1.060686608766762e+01 1.060000000000000e-13 5.329070518200751e-15 PASS
Energy [step 20] -1.060637180959050e+01 -1.060637180959051e+01 1.060000000000000e-13 1.598721155460225e-14 PASS
Multipoles [step 1] -3.902819473849961e-15 1.824331091466839e-16 4.490000000000000e-15 -4.085252582996645e-15 PASS
Multipoles [step 20] -1.265424097632667e-01 -1.265424097632642e-01 2.840000000000000e-15 -2.553512956637860e-15 PASS
Compare to other inputs