Match 1st TDA force 1 1
Commits >
Commit adf3952efd5c2bdc0cc9389163d26498c92cbe64 >
Run foss_mpi_debug_autotools: [foss2023a-mpi] >
Input 01-casida.05-casida.inp
Value | Reference | Precision | Status |
-2.419290000000000e-01 | -2.419220000000000e-01 | 1.210000000000000e-05 | PASS |
Command: LINEFIELD(casida/tamm_dancoff_excitations/forces_00001.xsf, 2, 5)