Match Energy [step 103]
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run cuda-mpi-omp: [foss2022a-cuda-mpi] >
Input 23-td_qedft_breit_pxlda_adiabatic.03-td_restart.inp
Value | Reference | Precision | Status |
-1.351222686779596e+01 | -1.351222686779602e+01 | 3.420000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)