Match 1st TDA force 1 1
Commits >
Commit 995bec41f97239ed4859b75e5397558b96cd16ab >
Run spack_foss-2023a_serial_opt >
Input 01-casida.05-casida.inp
Value | Reference | Precision | Status |
-2.419220000000000e-01 | -2.419220000000000e-01 | 1.210000000000000e-05 | PASS |
Command: LINEFIELD(casida/tamm_dancoff_excitations/forces_00001.xsf, 2, 5)