Input 01-propagators.03-etrs_taylor.inp

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

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766762e+01 -1.060686608766762e+01 1.060000000000000e-13 3.552713678800501e-15 PASS
Energy [step 20] -1.060637205318230e+01 -1.060637205318229e+01 1.060000000000000e-13 -1.065814103640150e-14 PASS
Multipoles [step 0] 4.185191256056431e-15 1.824331091466839e-16 4.490000000000000e-15 4.002758146909747e-15 PASS
Multipoles [step 20] -1.265536606512508e-01 -1.265536606512522e-01 4.000000000000000e-15 1.360023205165817e-15 PASS
Forces [step 0] 8.537673799433465e-02 8.537673799433354e-02 1.250000000000000e-14 1.110223024625157e-15 PASS
Forces [step 20] 7.966960326023331e-02 7.966960326023464e-02 7.820000000000000e-15 -1.332267629550188e-15 PASS
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