Match 1st TDA force 1 1
Commits >
Commit 22a7b3628f7ddff53691f80b422d9224cf7a2498 >
Run spack_foss-2022a_cuda_mpi_omp >
Input 01-casida.08-casida_restart.inp
Value | Reference | Precision | Status |
-2.712920000000000e-01 | -2.712920000000000e-01 | 1.360000000000000e-05 | PASS |
Command: LINEFIELD(casida/tamm_dancoff_excitations/forces_00001.xsf, 2, 5)