Input 02-propagators.02-cnsparskit.inp

Commits > Commit dd0acda4415b0ab64c529ca4a26922f9782edb94 > Run spack_foss-2022a_cuda_serial

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537673799433776e-02 8.537673799433354e-02 5.130000000000000e-15 4.218847493575595e-15 PASS
Forces [step 20] 7.964959635257740e-02 7.964959635257580e-02 3.980000000000000e-15 1.595945597898663e-15 PASS
Energy [step 1] -1.060686608766758e+01 -1.060686608766762e+01 1.060000000000000e-13 4.085620730620576e-14 PASS
Energy [step 20] -1.060637261154880e+01 -1.060637261154880e+01 1.060000000000000e-13 5.329070518200751e-15 PASS
Multipoles [step 1] 1.273698614840443e-15 1.824331091466839e-16 4.490000000000000e-15 1.091265505693759e-15 PASS
Multipoles [step 20] -1.265304528942152e-01 -1.265304528942171e-01 2.110000000000000e-15 1.942890293094024e-15 PASS
Compare to other inputs