Input 16-sparskit.02-kick.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run eb_foss-2022b_libxc6

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058495024056696e+01 -1.058495024056700e+01 5.290000000000000e-14 4.085620730620576e-14 PASS
Energy [step 5] -1.042950048806360e+01 -1.042950048806360e+01 5.210000000000000e-14 1.776356839400250e-15 PASS
Energy [step 10] -1.042949458890976e+01 -1.042949458890970e+01 5.210000000000000e-13 -6.217248937900877e-14 PASS
Energy [step 15] -1.042949286373713e+01 -1.042949286373710e+01 5.210000000000000e-13 -3.552713678800501e-14 PASS
Energy [step 20] -1.042949290569552e+01 -1.042949290569560e+01 5.210000000000000e-13 8.171241461241152e-14 PASS
Dipole [step 1] -5.128417222138859e-16 -4.333620525691201e-16 7.190000000000000e-15 -7.947966964476585e-17 PASS
Dipole [step 5] -7.295378300608436e-01 -7.295378300608580e-01 3.650000000000000e-14 1.443289932012704e-14 PASS
Dipole [step 10] -1.339265738796751e+00 -1.339265738796780e+00 1.000000000000000e-10 2.930988785010413e-14 PASS
Dipole [step 15] -1.833833130199216e+00 -1.833833130199210e+00 9.170000000000000e-14 -6.439293542825908e-15 PASS
Dipole [step 20] -2.215306184110944e+00 -2.215306184110940e+00 1.110000000000000e-13 -3.996802888650564e-15 PASS
Compare to other inputs