Match Density matrix (Im) [step 100]
Commits >
Commit e4c059220ca1a60f4b3fbcd10e5162435e5fcc26 >
Run cuda-mpi-omp: [foss2022a-cuda-mpi] >
Input 02-qd_2e_2d.02-td.inp
Value | Reference | Precision | Status |
-8.352999999999999e-20 | 0.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(output_iter/td.0000100/modelmb/densmatr_ip001_imb01, 41905, 6)