Match Density matrix 1
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_mpi_min_autotools: [foss2023a-mpi] >
Input 02-qd_2e_2d.01-gs.inp
Value | Reference | Precision | Status |
8.243000000000000e-02 | 8.243000000000000e-02 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(static/modelmb/densmatr_ip001_imb01, 41905, 5)