Input 01-propagators.05-etrs_chebyshev.inp

Commits > Commit 7a2379c5947d58fb2522a5e1a0c4903dfa35a523 > Run spack_foss-2023a_valgrind

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205383e+01 -1.060684240205380e+01 5.300000000000000e-14 -3.019806626980426e-14 PASS
Energy [step 20] -1.059303740001094e+01 -1.059303740000000e+01 5.300000000000000e-07 -1.094413448754494e-11 PASS
Multipoles [step 0] -6.307347222636595e-16 2.282730401188460e-15 4.670000000000000e-15 -2.913465123452119e-15 PASS
Multipoles [step 20] -1.269358520168095e-01 -1.269358520168070e-01 6.100000000000000e-15 -2.470246229790973e-15 PASS
Forces [step 0] 8.537491810749476e-02 8.537491810749601e-02 8.799999999999999e-15 -1.249000902703301e-15 PASS
Forces [step 20] 7.713156481503702e-02 7.713156481503500e-02 4.000000000000000e-14 2.026157019940911e-15 PASS
Compare to other inputs