Match 1st TDA force 1 1
Commits >
Commit a41c007d955b10e3b7368ff6ffc60ddf6399c944 >
Run foss_autotools: [foss2023b-serial] >
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)