Input 05-ks_inversion.01-target_density.inp

Commits > Commit f72050fe95608e153e1887ef05d1ad42dc082fde > Run cuda-mpi-omp: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Density value 1 6.829759188308920e-15 7.088584562382500e-15 1.000000000000000e-04 -2.588253740735802e-16 PASS
Density value 2 8.869699295184240e-01 8.869699063237690e-01 1.000000000000000e-04 2.319465497446771e-08 PASS
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