Input 14-silicon_shifts.03-td_parstates.inp

Commits > Commit 4eed2c655b9f478fca43a397c5feb863f7436add > Run eb_foss-2022b_libxc6_mpi

Matches

Name Value Reference Precision Difference Status
Number of excited electrons [step 100] 6.185346703579953e-05 6.185219895782357e-05 3.230000000000000e-09 1.268077975957738e-09 PASS
Projections [step 100] 9.402375131965531e-01 9.400425766754038e-01 3.140000000000000e-04 1.949365211493248e-04 PASS
Projections [step 100] -3.405135153803505e-01 -3.410432996471690e-01 5.830000000000000e-04 5.297842668185448e-04 PASS
Total current [step 100] -1.213690977663302e-02 1.226255951247051e-02 2.680000000000000e-02 -2.439946928910353e-02 PASS
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