Input 14-silicon_shifts.03-td_parstates.inp

Commits > Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 > Run intel-2022a_omp

Matches

Name Value Reference Precision Difference Status
Number of excited electrons [step 100] 6.185349321224942e-05 6.185219895782357e-05 3.230000000000000e-09 1.294254425854291e-09 PASS
Projections [step 100] 9.402375124614395e-01 9.400425766754038e-01 3.140000000000000e-04 1.949357860356882e-04 PASS
Projections [step 100] -3.405135202447567e-01 -3.410432996471690e-01 5.830000000000000e-04 5.297794024122782e-04 PASS
Total current [step 100] -1.213965649455375e-02 1.226255951247051e-02 2.680000000000000e-02 -2.440221600702425e-02 PASS
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