Match Density matrix (Im) [step 100]
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 02-qd_2e_2d.02-td.inp
Value | Reference | Precision | Status |
0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(output_iter/td.0000100/modelmb/densmatr_ip001_imb01, 41905, 6)