Input 16-sparskit.02-kick.inp

Commits > Commit bf0f47cf3302df97f9487d18148dd4e0cf599eb9 > Run eb_foss-2022a_mpi_debug

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058495024056698e+01 -1.058495024056700e+01 5.290000000000000e-14 2.309263891220326e-14 PASS
Energy [step 5] -1.042950048806358e+01 -1.042950048806360e+01 5.210000000000000e-14 1.953992523340276e-14 PASS
Energy [step 10] -1.042949458890975e+01 -1.042949458890970e+01 5.210000000000000e-13 -5.329070518200751e-14 PASS
Energy [step 15] -1.042949286373713e+01 -1.042949286373710e+01 5.210000000000000e-13 -3.375077994860476e-14 PASS
Energy [step 20] -1.042949290569554e+01 -1.042949290569560e+01 5.210000000000000e-13 5.861977570020827e-14 PASS
Dipole [step 1] 1.110223024625157e-15 -4.333620525691201e-16 7.190000000000000e-15 1.543585077194277e-15 PASS
Dipole [step 5] -7.295378300608397e-01 -7.295378300608580e-01 3.650000000000000e-14 1.831867990631508e-14 PASS
Dipole [step 10] -1.339265738796747e+00 -1.339265738796780e+00 1.000000000000000e-10 3.286260152890463e-14 PASS
Dipole [step 15] -1.833833130199212e+00 -1.833833130199210e+00 9.170000000000000e-14 -2.442490654175344e-15 PASS
Dipole [step 20] -2.215306184110935e+00 -2.215306184110940e+00 1.110000000000000e-13 4.440892098500626e-15 PASS
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