Input 02-propagators.03-rungekutta2.inp

Commits > Commit 119356330ffc33ec037b7259f31bc868121af1f1 > Run spack_foss-2022a_cuda_serial

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537491810749476e-02 8.537491810749601e-02 8.300000000000000e-15 -1.249000902703301e-15 PASS
Forces [step 20] 7.964951323736580e-02 7.964951323736311e-02 4.850000000000000e-15 2.692290834716005e-15 PASS
Energy [step 1] -1.060684240205380e+01 -1.060684240205380e+01 5.300000000000000e-14 -1.776356839400250e-15 PASS
Energy [step 20] -1.060631714875432e+01 -1.060631714875430e+01 5.300000000000000e-13 -1.776356839400250e-14 PASS
Multipoles [step 1] 1.405064907196267e-15 2.282730401188460e-15 4.670000000000000e-15 -8.776654939921929e-16 PASS
Multipoles [step 20] -1.266335332353804e-01 -1.266335332353800e-01 6.330000000000001e-14 -3.608224830031759e-16 PASS
Compare to other inputs