Input 02-propagators.02-cnsparskit.inp

Commits > Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e > Run foss_mpi_autotools: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537673799433465e-02 8.537673799433354e-02 1.250000000000000e-14 1.110223024625157e-15 PASS
Forces [step 20] 7.964959635257429e-02 7.964959635257580e-02 7.040000000000000e-15 -1.512678871051776e-15 PASS
Energy [step 1] -1.060686608766763e+01 -1.060686608766762e+01 1.060000000000000e-13 -7.105427357601002e-15 PASS
Energy [step 20] -1.060637261154880e+01 -1.060637261154880e+01 1.060000000000000e-13 -3.552713678800501e-15 PASS
Multipoles [step 1] -3.735878793820202e-17 1.824331091466839e-16 4.490000000000000e-15 -2.197918970848859e-16 PASS
Multipoles [step 20] -1.265304528942188e-01 -1.265304528942171e-01 6.810000000000000e-15 -1.665334536937735e-15 PASS
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