Input 14-silicon_shifts.03-td_parstates.inp

Commits > Commit bb161c2d0107cec853e686df3a469ebc444968d7 > Run foss_mpi_autotools: [foss2022a-mpi]

Matches

Name Value Reference Precision Difference Status
Number of excited electrons [step 100] 6.185355115367885e-05 6.185219895782357e-05 3.230000000000000e-09 1.352195855286453e-09 PASS
Projections [step 100] 9.402375135800989e-01 9.400425766754038e-01 3.140000000000000e-04 1.949369046950755e-04 PASS
Projections [step 100] -3.405135141948857e-01 -3.410432996471690e-01 5.830000000000000e-04 5.297854522833267e-04 PASS
Total current [step 100] -1.213682529318211e-02 1.226255951247051e-02 2.680000000000000e-02 -2.439938480565262e-02 PASS
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