Match 1st TDA force 1 1
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_mpi_autotools: [foss2023a-mpi] >
Input 01-casida.08-casida_restart.inp
Value | Reference | Precision | Status |
-2.713000000000000e-01 | -2.712920000000000e-01 | 1.360000000000000e-05 | PASS |
Command: LINEFIELD(casida/tamm_dancoff_excitations/forces_00001.xsf, 2, 5)