Input 14-silicon_shifts.02-td.inp

Commits > Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc > Run cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda]

Matches

Name Value Reference Precision Difference Status
Total current [step 100] 1.226264647081486e-02 1.226258909460747e-02 7.880000000000000e-08 5.737620738591187e-08 PASS
Projections [step 100] 9.400425795916098e-01 9.400425513188146e-01 3.650000000000000e-08 2.827279510508873e-08 PASS
Projections [step 100] -3.410432915472856e-01 -3.410433695125176e-01 1.010000000000000e-07 7.796523204817163e-08 PASS
Stress (11) [step 100] 8.567586284000001e-05 8.567591270000000e-05 1.560000000000000e-10 -4.985999999917827e-11 PASS
Stress (11) [step 0] -5.966737709000000e-04 -5.966738591000001e-04 9.700000000000000e-11 8.820000003788298e-11 PASS
Stress (12) [step 0] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Stress (13) [step 0] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Stress (21) [step 0] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Stress (22) [step 0] -5.980850127000000e-04 -5.980850990000000e-04 9.480000000000000e-11 8.630000002379096e-11 PASS
Stress (23) [step 0] 6.403048972000000e-06 6.403092598000000e-06 4.800000000000000e-11 -4.362600000049315e-11 PASS
Stress (31) [step 0] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Stress (32) [step 0] 6.403048972000000e-06 6.403092598000000e-06 4.800000000000000e-11 -4.362600000049315e-11 PASS
Stress (33) [step 0] -5.980850127000000e-04 -5.980850990000000e-04 9.480000000000000e-11 8.630000002379096e-11 PASS
Stress (12) [step 100] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Stress (13) [step 100] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Stress (21) [step 100] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Stress (22) [step 100] 8.428687413000000e-05 8.428682922000001e-05 5.260000000000000e-11 4.490999999456294e-11 PASS
Stress (23) [step 100] 6.471854865000000e-06 6.471860535000001e-06 9.190000000000000e-11 -5.670000001297890e-12 PASS
Stress (31) [step 100] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Stress (32) [step 100] 6.471854865000000e-06 6.471860535000001e-06 9.190000000000000e-11 -5.670000001297890e-12 PASS
Stress (33) [step 100] 8.428687413000000e-05 8.428682922000001e-05 5.260000000000000e-11 4.490999999456294e-11 PASS
Number of excited electrons [step 100] 6.185358566518362e-05 6.185436383068788e-05 1.050000000000000e-09 -7.781655042560232e-10 PASS
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