Input 01-propagators.08-cn.inp

Commits > Commit babc485c55a2119a415aa56305cb49f398154cb7 > Run spack_intel-2022a_serial_omp

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205382e+01 -1.060684240205380e+01 5.300000000000000e-14 -2.309263891220326e-14 PASS
Energy [step 20] -1.060634888678688e+01 -1.060634888678690e+01 5.300000000000000e-14 2.131628207280301e-14 PASS
Multipoles [step 0] 5.133206359975162e-15 2.282730401188460e-15 4.670000000000000e-15 2.850475958786702e-15 PASS
Multipoles [step 20] -1.265308523252142e-01 -1.265308523249920e-01 2.570000000000000e-13 -2.222111383787251e-13 PASS
Forces [step 0] 8.537491810749209e-02 8.537491810749601e-02 8.799999999999999e-15 -3.913536161803677e-15 PASS
Forces [step 20] 7.964815083499488e-02 7.964815083600001e-02 3.980000000000000e-11 -1.005126537556578e-12 PASS
Compare to other inputs