Input 01-propagators.02-expmid.inp

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Run spack_intel-2023a_impi

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537673799433465e-02 8.537673799433354e-02 5.130000000000000e-15 1.110223024625157e-15 PASS
Forces [step 20] 7.966840852244594e-02 7.966840852244794e-02 4.150000000000000e-15 -1.998401444325282e-15 PASS
Energy [step 1] -1.060686608766765e+01 -1.060686608766762e+01 1.060000000000000e-13 -3.375077994860476e-14 PASS
Energy [step 20] -1.060637353666412e+01 -1.060637353666412e+01 1.060000000000000e-13 -5.329070518200751e-15 PASS
Multipoles [step 1] -1.170343729155372e-15 1.824331091466839e-16 4.490000000000000e-15 -1.352776838302056e-15 PASS
Multipoles [step 20] -1.265509663990624e-01 -1.265509663990613e-01 2.080000000000000e-15 -1.054711873393899e-15 PASS
Compare to other inputs