Input 01-propagators.05-etrs_chebyshev.inp

Commits > Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf > Run spack_intel-2023a_serial

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205382e+01 -1.060684240205380e+01 5.300000000000000e-14 -2.131628207280301e-14 PASS
Energy [step 20] -1.059303740001093e+01 -1.059303740000000e+01 5.300000000000000e-07 -1.093169998966914e-11 PASS
Multipoles [step 0] 2.566881826722173e-15 2.282730401188460e-15 4.670000000000000e-15 2.841514255337135e-16 PASS
Multipoles [step 20] -1.269358520168062e-01 -1.269358520168070e-01 6.100000000000000e-15 8.326672684688674e-16 PASS
Forces [step 0] 8.537491810749165e-02 8.537491810749601e-02 8.799999999999999e-15 -4.357625371653739e-15 PASS
Forces [step 20] 7.713156481503436e-02 7.713156481503500e-02 4.000000000000000e-14 -6.383782391594650e-16 PASS
Compare to other inputs