Input 06-restart.07-restart_td_calc.inp
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| TD start | 7.000000000000001e-01 | 7.000000000000000e-01 | 4.260000000000000e-05 | 1.110223024625157e-16 | PASS |
| charge [up] | 0.000000000000000e+00 | 0.000000000000000e+00 | 4.260000000000000e-05 | 0.000000000000000e+00 | PASS |
| charge [dn] | 9.999999999983189e-01 | 9.999999999983000e-01 | 4.260000000000000e-05 | 1.887379141862766e-14 | PASS |
| <x> [dn] | -6.969714963266143e-03 | -6.969717724775000e-03 | 4.260000000000000e-05 | 2.761508856655159e-09 | PASS |