Input 14-silicon_shifts.03-td_parstates.inp

Commits > Commit bb161c2d0107cec853e686df3a469ebc444968d7 > Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
Number of excited electrons [step 100] 6.185360488242253e-05 6.185219895782357e-05 3.230000000000000e-09 1.405924598962827e-09 PASS
Projections [step 100] 9.402375129931977e-01 9.400425766754038e-01 3.140000000000000e-04 1.949363177938812e-04 PASS
Projections [step 100] -3.405135159431491e-01 -3.410432996471690e-01 5.830000000000000e-04 5.297837040199038e-04 PASS
Total current [step 100] -1.213690910285635e-02 1.226255951247051e-02 2.680000000000000e-02 -2.439946861532686e-02 PASS
Compare to other inputs