Input 14-silicon_shifts.03-td_parstates.inp

Commits > Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 > Run intel-2022a_impi

Matches

Name Value Reference Precision Difference Status
Number of excited electrons [step 100] 6.185346301662564e-05 6.185219895782357e-05 3.230000000000000e-09 1.264058802075141e-09 PASS
Projections [step 100] 9.402375130738215e-01 9.400425766754038e-01 3.140000000000000e-04 1.949363984177221e-04 PASS
Projections [step 100] -3.405135157166216e-01 -3.410432996471690e-01 5.830000000000000e-04 5.297839305474228e-04 PASS
Total current [step 100] -1.213691209289001e-02 1.226255951247051e-02 2.680000000000000e-02 -2.439947160536052e-02 PASS
Compare to other inputs