Match Density matrix (Re) [step 100]
Commits >
Commit 3c5618978387ff506850febf67c434621a2adfa2 >
Run foss-mpi-min: [foss2022a-mpi] >
Input 02-qd_2e_2d.02-td.inp
Value | Reference | Precision | Status |
8.223000000000000e-02 | 8.223000000000000e-02 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(output_iter/td.0000100/modelmb/densmatr_ip001_imb01, 41905, 5)