Input 14-silicon_shifts.03-td_parstates.inp

Commits > Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 > Run foss-mpi-opt-full: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Projections [step 100] 9.402375138265713e-01 9.400425766754038e-01 3.140000000000000e-04 1.949371511674736e-04 PASS
Projections [step 100] -3.405135136500122e-01 -3.410432996471690e-01 5.830000000000000e-04 5.297859971568064e-04 PASS
Total current [step 100] -1.213690344429428e-02 1.226255951247051e-02 2.680000000000000e-02 -2.439946295676479e-02 PASS
Number of excited electrons [step 100] 2.021242673400092e-05 2.020866884308581e-05 4.460000000000000e-09 3.757890915109195e-09 PASS
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